Methyl 3- (4-bromophenyl) acrylate

CAT: 0127-OR1007650-01Size: 10 gDry Ice: NoHazardous: No

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CAT#:0127-OR1007650-01Size:10 g

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CAS Number

3650-78-0

Purity

98%

Smiles

O=C(OC)/C=C/C1=CC=C(Br)C=C1

Chemical Information

Methyl 4-bromocinnamate

CAS Number	3650-78-0
PubChem CID	816774
IUPAC Name	methyl (E)-3-(4-bromophenyl)prop-2-enoate
Molecular Formula	C10H9BrO2
Molecular Weight	241.08
XLogP	3.3
Topological Polar Surface Area	26.3
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	3
Heavy Atom Count	13
Formal Charge	0
Complexity	193

SMILES

COC(=O)/C=C/C1=CC=C(C=C1)Br

InChI

InChI=1S/C10H9BrO2/c1-13-10(12)7-4-8-2-5-9(11)6-3-8/h2-7H,1H3/b7-4+

InChIKey

MFKOGXVHZUSUAF-QPJJXVBHSA-N

Chemical Structure

2D Structure

CAS: 3650-78-0

CID: 816774

Formula: C10H9BrO2

MW: 241.08

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	241.08
XLogP3	3.3
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	3
Exact Mass	239.97859
Monoisotopic Mass	239.97859
Topological Polar Surface Area	26.3 Å²
Heavy Atom Count	13
Formal Charge	0
Complexity	193
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	1
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
OR1065197-01	4-Bromophenyl acrylate
OR1029851-01	Ethyl-3- (4-bromophenyl) acrylate
OR1029662-01	(E) -Ethyl 3- (4-Bromophenyl) acrylate
OR1001746-01	Ethyl 3- (3-bromophenyl) acrylate
OR942301-01	Methyl 3- (4-formylphenyl) acrylate
OR955608	Methyl-3- (4-pyridyl) acrylate
OR962483-01	Methyl 3- (4-cyanophenyl) acrylate
OR1037828-01	Ethyl 3- (2-bromophenyl) acrylate
OR110770	Methyl 3- (3,4-dichlorophenyl) acrylate
OR1023608-01	Methyl 3- (3,4-Dihydroxyphenyl) Acrylate

Catalog	Name
sc-311400A	Methyl 3- (4-bromophenyl) acrylate
WCA20517-01	(E) -Methyl 3- (4-bromophenyl) acrylate
sc-263472A	Methyl (E) -3- (4-bromophenyl) acrylate
FM168867-01	Methyl 3- (4-isopropylphenyl) acrylate
sc-301043	Methyl 3- (4-hydroxyphenyl) acrylate
455072-01	Methyl 3- (4-cyanophenyl) acrylate
FM170005	Methyl 3-[4- (benzyloxy) phenyl]acrylate
283733-01	(E) -Methyl 3- (4-cyanophenyl) acrylate
sc-358319	Methyl 3-[4- (trifluoromethoxy) phenyl]acrylate
VAA88395-01	Methyl 3- (3,4-dichlorophenyl) acrylate