Name: Name:1-[(thiophen-2-yl)methyl]cyclohexane-1-carboxylic acid
Brand: Angene
SKU: AG01BC6W
Rating: 90 (10 reviews)

1-[(thiophen-2-yl)methyl]cyclohexane-1-carboxylic acid

CAS No.:

78502-09-7

Catalog Number:

AG01BC6W

Molecular Formula:

C12H16O2S

Molecular Weight:

224.3192

Catalog Number:

AG01BC6W

Chemical Name:

1-[(thiophen-2-yl)methyl]cyclohexane-1-carboxylic acid

CAS Number:

78502-09-7

Molecular Formula:

C12H16O2S

Molecular Weight:

224.3192

MDL Number:

MFCD16855601

IUPAC Name:

1-(thiophen-2-ylmethyl)cyclohexane-1-carboxylic acid

InChI:

InChI=1S/C12H16O2S/c13-11(14)12(6-2-1-3-7-12)9-10-5-4-8-15-10/h4-5,8H,1-3,6-7,9H2,(H,13,14)

InChI Key:

LIUGOBYBABOLNX-UHFFFAOYSA-N

SMILES:

OC(=O)C1(CCCCC1)Cc1cccs1

Complexity:

234

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

224.087g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

224.318g/mol

Monoisotopic Mass:

224.087g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

65.5A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.4