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Structure

4-Bromocrotonic acid

CAS
13991-36-1
Catalog Number
ACM13991361
Category
Other Products
Molecular Weight
164.99
Molecular Formula
C4H5BrO2

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Specification

Synonyms
4-BROMOCROTONIC ACID;TRANS-4-BROMO-2-BUTENOIC ACID;2-Butenoic acid, 4-bromo-, (E)-;4-BroMobut-2-enoic acid;(2E)-4-Bromo-2-butenoic acid;(E)-4-Bromo-2-butenoic acid;(E)-4-Bromocrotonic acid;2-Butenoic acid,4-broMo-, (2E)-
Boiling Point
288°C
Melting Point
74°C
Flash Point
128°C
Density
1.718
Safety Description
36/37/39
Supplemental Hazard Statements
H290-H314
Symbol
GHS05
What is the IUPAC name of 4-Bromocrotonic acid?

(E)-4-bromobut-2-enoic acid

What is the molecular formula of 4-Bromocrotonic acid?

C4H5BrO2

What is the molecular weight of 4-Bromocrotonic acid?

164.99 g/mol

What is the InChI of 4-Bromocrotonic acid?

InChI=1S/C4H5BrO2/c5-3-1-2-4(6)7/h1-2H,3H2,(H,6,7)/b2-1+

What is the InChIKey of 4-Bromocrotonic acid?

DOTGZROJTAUYFQ-OWOJBTEDSA-N

What is the canonical SMILES notation of 4-Bromocrotonic acid?

C(C=CC(=O)O)Br

What is the isomeric SMILES notation of 4-Bromocrotonic acid?

C(/C=C/C(=O)O)Br

What is the CAS number of 4-Bromocrotonic acid?

13991-36-1

What is the EC number of 4-Bromocrotonic acid?

678-082-8

Is 4-Bromocrotonic acid a canonicalized compound?

Yes

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