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Tert-butyl bis(2-chloroethyl)carbamate

Product Name
Tert-butyl bis(2-chloroethyl)carbamate
CAS No.
118753-70-1
Chemical Name
Tert-butyl bis(2-chloroethyl)carbamate
Synonyms
TERT-BUTYL BIS(2-CHLOROETHYL)CARBAMATE;N-Boc-N;N-Boc-N,N-bis(2-chL;N-bis(2-chloroethyl)amine;N-Boc-Bis(2-chloroethyl) amine;N-BOC-N,N-BIS(2-CHLOROETHYL)AMINE;N-BOC-N,N-Bis(2-chloroethyl)amine 95%;N-Boc-N,N-bis(2-chloroethyl)amine ,95%;CarbaMic acid, bis(2-chloroethyl)-, 1,1-;Bis(2-chloroethyl)-tert-butoxycarbonylaMine
CBNumber
CB6715694
Molecular Formula
C9H17Cl2NO2
Formula Weight
242.14
MOL File
118753-70-1.mol
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Tert-butyl bis(2-chloroethyl)carbamate Property

Boiling point:
290.7±33.0 °C(Predicted)
Density 
1.149±0.06 g/cm3(Predicted)
Flash point:
130 °C
storage temp. 
Sealed in dry,Store in freezer, under -20°C
pka
-1.73±0.70(Predicted)
form 
liquid
color 
Hazy/turbid
Specific Gravity
1.14
InChI
InChI=1S/C9H17Cl2NO2/c1-9(2,3)14-8(13)12(6-4-10)7-5-11/h4-7H2,1-3H3
InChIKey
FQZLNQAUUMSUHT-UHFFFAOYSA-N
SMILES
C(OC(C)(C)C)(=O)N(CCCl)CCCl
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Safety

HS Code 
2933199090
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Hazard and Precautionary Statements (GHS)

Symbol(GHS)
Signal word
Warning
Hazard statements

H315Causes skin irritation

H319Causes serious eye irritation

H335May cause respiratory irritation

Precautionary statements

P261Avoid breathing dust/fume/gas/mist/vapours/spray.

P305+P351+P338IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing.

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N-Bromosuccinimide Price

TRC
Product number
B601873
Product name
N-Boc-N,N-bis(2-chloroethyl)amine
Packaging
10mg
Price
$45
Updated
2021/12/16
Synthonix
Product number
B3954
Product name
tert-ButylN,N-bis(2-chloroethyl)carbamate
Purity
95%
Packaging
1g
Price
$15
Updated
2021/12/16
Synthonix
Product number
B3954
Product name
tert-ButylN,N-bis(2-chloroethyl)carbamate
Purity
95%
Packaging
5g
Price
$20
Updated
2021/12/16
Apolloscientific
Product number
OR315132
Product name
N-BOC-N,N-Bis(2-chloroethyl)amine
Purity
95%
Packaging
5g
Price
$52
Updated
2021/12/16
Synthonix
Product number
B3954
Product name
tert-ButylN,N-bis(2-chloroethyl)carbamate
Purity
95%
Packaging
25g
Price
$60
Updated
2021/12/16
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Tert-butyl bis(2-chloroethyl)carbamate Chemical Properties,Usage,Production

Uses

Tert-butyl bis(2-chloroethyl)carbamate is a derivative of bis(2-chloroethyl)amine, which is used as a medicinal chemistry and organic synthesis intermediate, where the Boc group in the structure is readily removed to obtain the active carboxyl group in the organic synthesis transformation. And bis(2-chloroethyl)amine is an anticancer drug that acts as a DNA alkylating agent. It induces apoptosis in human hepatocellular carcinoma cells. It has been shown to be effective against drug-resistant mutants and is used in the treatment of tuberculosis.

Synthesis

24424-99-5

821-48-7

118753-70-1

In a 500 mL three-necked flask, 100 g of bis(2-chloroethyl)amine hydrochloride (IV) was added and dissolved in 300 mL of dichloromethane, followed by the addition of 113 g of triethylamine, and the slow dropwise addition of 147 g of di-tert-butyl dicarbonate (Boc anhydride) with continuous stirring, and the reaction was carried out for 4-6 hours. After completion of the reaction, 200 mL of purified water was added for liquid-liquid separation, followed by washing the organic phase with 200 mL of saturated sodium chloride solution and drying the organic layer with anhydrous sodium sulfate. After drying, concentration under reduced pressure afforded 133 g of tert-butyl N,N-bis(2-chloroethyl)carbamate (V) in 98% yield.

References

[1] Tetrahedron, 2004, vol. 60, # 22, p. 4875 - 4878
[2] Patent: US2003/187020, 2003, A1
[3] Patent: WO2006/46024, 2006, A1. Location in patent: Page/Page column 146
[4] Patent: WO2007/125321, 2007, A2. Location in patent: Page/Page column 140-141
[5] Patent: US2003/229067, 2003, A1. Location in patent: Page 26

Tert-butyl bis(2-chloroethyl)carbamate Preparation Products And Raw materials

Raw materials

Di-tert-butyl dicarbonate Triethylamine Diethyl ether Bis(2-chloroethyl)amine hydrochloride

Preparation Products

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View Lastest Price from Tert-butyl bis(2-chloroethyl)carbamate manufacturers

Sach biotech Co.,Ltd
Product
Tert-butyl bis(2-chloroethyl)carbamate 118753-70-1
Price
US $223.00-200.00/kg
Min. Order
1kg
Purity
98%
Supply Ability
5mt
Release date
2025-06-11
Career Henan Chemical Co
Product
N-Boc-N,N-bis(2-chloroethyl)amine 118753-70-1
Price
US $8.00/kg
Min. Order
1kg
Purity
99%
Supply Ability
10tons
Release date
2018-12-24

118753-70-1, Tert-butyl bis(2-chloroethyl)carbamateRelated Search:

FMOC-LYS(ALOC)-OH tert-Butyl carbamate 2-Chloroethyl carbamate Tert-butyl bis(2-chloroethyl)carbamate

  • TERT-BUTYL BIS(2-CHLOROETHYL)CARBAMATE
  • bis(2-chloroethyl)-carbamic acid tert-butyl ester
  • N-Boc-N,N-bis(2-chloroethyl)amine ,95%
  • Bis(2-chloroethyl)-N-(tert-butoxycarbonyl)aMine
  • Bis(2-chloroethyl)-tert-butoxycarbonylaMine
  • CarbaMic acid, bis(2-chloroethyl)-, 1,1-diMethylethyl ester (9CI)
  • Carbamic acid,N,N-bis(2-chloroethyl)-, 1,1-dimethylethyl ester
  • N-Boc-Bis(2-chloroethyl) amine
  • N-BOC-N,N-BIS(2-CHLOROETHYL)AMINE
  • N,N-Bis(2-chloroethyl)carbamic acid tert-butyl ester
  • CarbaMic acid, bis(2-chloroethyl)-, 1,1-
  • N-BOC-N,N-Bis(2-chloroethyl)amine 95%
  • N. Tert butyl N-bis (2-chloroethyl) carbamate
  • N-Boc-N,N-bis(2-chL
  • N-Boc-N,N-bis(2-chloroethyl)amine ISO 9001：2015 REACH
  • N-bis(2-chloroethyl)amine
  • N-Boc-N
  • 1,1-Dimethylethyl N,N-bis(2-chloroethyl)carbamate
  • tert-Butyl N,N-bis(2-chloroethyl)carbamate - [B3954]
  • 118753-70-1
  • C9H17Cl2NO2
  • pharmacetical