2-Phenyl-1-(thiophen-2-yl)ethanone - CAS 13196-28-6

Catalog:	BB046212
Product Name:	2-Phenyl-1-(thiophen-2-yl)ethanone
CAS:	13196-28-6
Synonyms:	2-phenyl-1-(2-thienyl)ethanone; Ethanone, 2-phenyl-1-(2-thienyl)-; 2-phenyl-1-(2-thienyl)ethan-1-one

Technical Data

Computed Properties

IUPAC Name:	2-phenyl-1-thiophen-2-ylethanone
Description:	2-Phenyl-1-(thiophen-2-yl)ethanone (CAS# 13196-28-6 ) is a useful research chemical.
Molecular Weight:	202.27
Molecular Formula:	C12H10OS
Canonical SMILES:	C1=CC=C(C=C1)CC(=O)C2=CC=CS2
InChI:	InChI=1S/C12H10OS/c13-11(12-7-4-8-14-12)9-10-5-2-1-3-6-10/h1-8H,9H2
InChI Key:	HXMVINSKZVYIDI-UHFFFAOYSA-N
Boiling Point:	346.3±17.0 °C at 760 mmHg
Melting Point:	44.5 °C
Density:	1.2±0.1 g/cm³

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Related Functional Groups

Carbonyl Compounds

[51493-02-8]
N-Methyl-N-propylcarbamoyl Chloride
[959574-98-2]
(3-Phenyl-1H-pyrazol-1-yl)acetic acid
[1035840-45-9]
1-(5-Methoxy-1,3-benzoxazol-2-yl)piperidine-3-carboxylic acid
[956439-56-8]
1-(Carboxymethyl)-3-nitro-1H-pyrazole-5-carboxylic acid
[253429-30-0]
1-Bromo-2-(2,2-diethoxyethoxy)-4-fluorobenzene
[2168559-63-3]
2-(6-Methyl-2-pyridyl)acetic Acid Hydrochloride

Thiophenes

[832741-29-4]
1-(4-Bromo-5-propylthiophen-2-yl)ethanone
[13669-10-8]
Ethyl (2-thenoyl)acetate
[438220-53-2]
Ethyl 2-amino-4-(3,4-dimethylphenyl)-5-methylthiophene-3-carboxylate
[43028-63-3]
Ethyl 2-amino-5-carbamoyl-4-methylthiophene-3-carboxylate
[4815-37-6]
Ethyl 2-amino-5-methyl-4-phenylthiophene-3-carboxylate
[53090-46-3]
Ethyl 3-oxo-3-(3-thienyl)propionate

Complexity:	197
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	202.04523611
Formal Charge:	0
Heavy Atom Count:	14
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	202.04523611
Rotatable Bond Count:	3
Topological Polar Surface Area:	45.3
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	3.2