2- (4-Bromophenyl) thiophene

CAT: 0127-OR1416-01Size: 250 mgDry Ice: NoHazardous: No

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CAT#:0127-OR1416-01Size:250 mg

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CAS Number

40133-22-0

Synonyms

1-Bromo-4- (thien-2-yl) benzene

MDL Number

MFCD05664340

Purity

98%

Smiles

Brc1ccc(cc1)c2cccs2

Storage Conditions

Store at 2-8°C

Chemical Information

2-(4-Bromophenyl)thiophene

CAS Number	40133-22-0
PubChem CID	7018298
IUPAC Name	2-(4-bromophenyl)thiophene
Molecular Formula	C10H7BrS
Molecular Weight	239.13
XLogP	4.4
Topological Polar Surface Area	28.2
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	1
Heavy Atom Count	12
Formal Charge	0
Complexity	141

SMILES

C1=CSC(=C1)C2=CC=C(C=C2)Br

InChI

InChI=1S/C10H7BrS/c11-9-5-3-8(4-6-9)10-2-1-7-12-10/h1-7H

InChIKey

XKOJJKOSNQXQGP-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 40133-22-0

CID: 7018298

Formula: C10H7BrS

MW: 239.13

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	239.13
XLogP3	4.4
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	1
Exact Mass	237.94518
Monoisotopic Mass	237.94518
Topological Polar Surface Area	28.2 Å²
Heavy Atom Count	12
Formal Charge	0
Complexity	141
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
OR1097441	3- (4-Bromophenyl) thiophene
OR1422	2- (2-Bromophenyl) thiophene
PC520225	2- (4-Bromophenyl) -5- (difluoromethyl) thiophene
OR1079068-01	2- (4-Bromophenyl) benzo[b]thiophene
OR102870	4- (4-Bromophenyl) thiophene-2-carboxylic acid
OR22974-01	Ethyl 2-amino-4- (4-bromophenyl) thiophene-3-carboxylate
PC520201	2- (2-Bromophenyl) -5- (difluoromethyl) thiophene
OR81208-01	5- (4- (Bis (4-bromophenyl) amino) phenyl) thiophene-2-carbaldehyde
PC520221	2- (3-Bromophenyl) -5- (difluoromethyl) thiophene
OR1097440	3- (3-Bromophenyl) thiophene

Catalog	Name
TRC-B687735-10G	2-(4-Bromophenyl)thiophene
413675-01	2- (4-Bromophenyl) thiophene
sc-337972A	Methyl 4- (4-bromophenyl) thiophene-2-carboxylate
sc-336062	4- (4-Bromophenyl) thiophene-2-carbonyl chloride
sc-232231	4- (4-Bromophenyl) thiophene-2-carboxylic acid
266214-01	5- (4-Bromophenyl) thiophene-2-carbohydrazide
sc-277902	5- (4-bromophenyl) thiophene-2-carbaldehyde
sc-255986	2- (2-Bromophenyl) thiophene
RG-E140915-01	2- (4-bromophenyl) -6-methoxybenzo[b]thiophene
sc-350006	5- (4-bromophenyl) thiophene-2-carboxylic acid