ChemicalBook > CAS DataBase List > 4-BROMOCROTONIC ACID

4-BROMOCROTONIC ACID

Product Name
4-BROMOCROTONIC ACID
CAS No.
13991-36-1
Chemical Name
4-BROMOCROTONIC ACID
Synonyms
4-bromocrotonic aci;4-BROMOCROTONIC ACID;r-bromocrotonic acid;Remazolam impurity 4;Neratinib Impurity 25;Remimazolam Impurity 4;4-BroMobut-2-enoic acid;gamma-Bromocrotonic acid;(E)-4-Bromocrotonic acid;4-Bromocrotonic Acid >
CBNumber
CB1669800
Molecular Formula
C4H5BrO2
Formula Weight
164.99
MOL File
13991-36-1.mol
More
Less

4-BROMOCROTONIC ACID Property

Melting point:
74 °C
Boiling point:
288℃
Density 
1.718
Flash point:
128℃
storage temp. 
Inert atmosphere,2-8°C
solubility 
Chloroform (Sparingly), Methanol (Slightly)
form 
Solid
pka
4.13±0.10(Predicted)
color 
Pale Yellow to Pale Beige
InChI
InChI=1S/C4H5BrO2/c5-3-1-2-4(6)7/h1-2H,3H2,(H,6,7)/b2-1+
InChIKey
DOTGZROJTAUYFQ-OWOJBTEDSA-N
SMILES
C(O)(=O)/C=C/CBr
CAS DataBase Reference
13991-36-1
More
Less

Safety

Risk Statements 
34
Safety Statements 
36/37/39
RIDADR 
3261
HazardClass 
8
PackingGroup 
III
HS Code 
29161900
More
Less

Hazard and Precautionary Statements (GHS)

Symbol(GHS)
Signal word
Danger
Hazard statements

H290May be corrosive to metals

H314Causes severe skin burns and eye damage

Precautionary statements

P234Keep only in original container.

P260Do not breathe dust/fume/gas/mist/vapours/spray.

P264Wash hands thoroughly after handling.

P264Wash skin thouroughly after handling.

P280Wear protective gloves/protective clothing/eye protection/face protection.

P390Absorb spillage to prevent material damage.

P405Store locked up.

P406Store in corrosive resistant/… container with a resistant inner liner.

P501Dispose of contents/container to..…

More
Less

N-Bromosuccinimide Price

TCI Chemical
Product number
B2298
Product name
4-Bromocrotonic Acid
Purity
>98.0%(GC)(T)
Packaging
1g
Price
$199
Updated
2025/07/31
TCI Chemical
Product number
B2298
Product name
4-Bromocrotonic Acid
Purity
>98.0%(GC)(T)
Packaging
5g
Price
$597
Updated
2025/07/31
TRC
Product number
B682580
Product name
(E)-4-BromocrotonicAcid
Packaging
5g
Price
$525
Updated
2021/12/16
TRC
Product number
B682580
Product name
(E)-4-BromocrotonicAcid
Packaging
1g
Price
$140
Updated
2021/12/16
Matrix Scientific
Product number
180966
Product name
(E)-4-Bromobut-2-enoic acid
Purity
95%+
Packaging
1g
Price
$150
Updated
2021/12/16
More
Less

4-BROMOCROTONIC ACID Chemical Properties,Usage,Production

Chemical Properties

White solid

Uses

(E)-4-Bromocrotonic Acid acts as a fatty acid blocking agent. It is used to selectively adjust levels of long-chain acyl CoA and carnitine in aerobic and ischemic myocardium. It is also an intermediate used to prepare tetrahydropyridothienopyrimidine derivatve with antiproliferative activities.

Synthesis

107-93-7

13991-36-1

General procedure for the synthesis of (E)-4-bromobut-2-enoic acid from crotonic acid: a mixture of (E)-but-2-enoic acid (10.00 g, 116.16 mmol), N-bromosuccinimide (NBS, 1.02 g, 118.48 mmol), and 2,2'-azobis(2-methylpropionitrile) (AIBN, 381.49 mg, 2.32 mmol ) were dissolved in carbon tetrachloride (CCl4, 120 mL) and the reaction was stirred at 90 °C for 4 hours. After completion of the reaction, the mixture was filtered and the filtrate was concentrated. The residue was recrystallized with hexane to afford the target product (E)-4-bromobut-2-enoic acid (19.17 g, 42.2% yield).

References

[1] Archiv der Pharmazie, 2014, vol. 347, # 8, p. 552 - 558
[2] Bioorganic and Medicinal Chemistry, 2014, vol. 22, # 7, p. 2366 - 2378
[3] Patent: CN107556289, 2018, A. Location in patent: Paragraph 0112; 0114; 0115; 0116
[4] Journal of Organic Chemistry, 2011, vol. 76, # 11, p. 4467 - 4481
[5] Tetrahedron Letters, 2018, vol. 59, # 18, p. 1776 - 1778

4-BROMOCROTONIC ACID Preparation Products And Raw materials

Raw materials

Preparation Products

More
Less

4-BROMOCROTONIC ACID Suppliers

GLR Innovations
Tel
+91 9891111994
Email
info@glrgroup.in
Country
India
ProdList
4535
Advantage
58
TCI Chemicals (India) Pvt. Ltd.
Tel
--
Fax
--
Email
sales-in@tcichemicals.com
Country
India
ProdList
6768
Advantage
58
Biosyn Research Chemicals
Tel
--
Fax
--
Email
info@biosyn.in
Country
India
ProdList
1340
Advantage
58
Parth Antibiotics Pvt., Ltd.
Tel
--
Fax
--
Email
info@parthantibiotics.com
Country
India
ProdList
137
Advantage
58
VASIN BIO LIFE SCIENCES PVT LTD
Tel
--
Fax
--
Email
info@vasinbio.com
Country
India
ProdList
2092
Advantage
58
Reax Chemicals
Tel
--
Fax
--
Country
India
ProdList
4217
Advantage
58
Vedanta Biosciences
Tel
--
Fax
--
Email
info@vedantabio.co.in
Country
India
ProdList
25
Advantage
58
Sakam Finechem Pvt., Ltd.
Tel
--
Fax
--
Email
info@sakamfinechem.com
Country
India
ProdList
556
Advantage
58
Molecraft LifeSciences Pvt Ltd
Tel
--
Fax
--
Email
info@molecraft.com
Country
India
ProdList
757
Advantage
0
A.J Chemicals
Tel
--
Fax
--
Email
sales@ajchem.in
Country
India
ProdList
6100
Advantage
58
More
Less

View Lastest Price from 4-BROMOCROTONIC ACID manufacturers

Henan Bao Enluo International TradeCo.,LTD
Product
4-BROMOCROTONIC ACID 13991-36-1
Price
US $50.00/kg
Min. Order
1kg
Purity
99%
Supply Ability
1000tons
Release date
2023-08-03
Hebei Best Biological Technology Co., Ltd
Product
4-bromocrotonic acid 13991-36-1
Price
US $200.00/g
Min. Order
10g
Purity
99%
Supply Ability
1000t/month
Release date
2022-11-10
Zhuozhou Wenxi import and Export Co., Ltd
Product
4-BROMOCROTONIC ACID 13991-36-1
Price
US $15.00-10.00/KG
Min. Order
1KG
Purity
99%+ HPLC
Supply Ability
Monthly supply of 1 ton
Release date
2021-06-27