Ethyl 2'-methyl[1,1'-biphenyl]-3-carboxylate

HCID 12853045

Basic information

CAS
76350-84-0
Standard SMILES
CCOC(=O)c1cccc(-c2ccccc2C)c1
InChIKey
ZPVOQGKXJAZROX-UHFFFAOYSA-N
Molecular formula
C16H16O2
Average molar mass
240.3 g/mol
Monoisotopic mass
240.11502975

Names & identifiers

Preferred name
Ethyl 2'-methyl[1,1'-biphenyl]-3-carboxylate
IUPAC
ethyl 3-(2-methylphenyl)benzoate
English name
[1,1'-Biphenyl]-3-carboxylic acid, 2'-Methyl-, ethyl ester
Molecular formula
C16H16O2
Molecular weight
240.3

Names & synonyms

76350-84-0Ethyl 2'-methyl[1,1'-biphenyl]-3-carboxylateETHYL 3-(2-METHYLPHENYL)BENZOATE[1,1'-Biphenyl]-3-carboxylic acid, 2'-methyl-, ethyl esterSCHEMBL3947571DTXSID50511499ZPVOQGKXJAZROX-UHFFFAOYSA-NAKOS0026834632'-Methyl-biphenyl-3-carboxylic acid ethyl ester

Database identifiers

CAS
76350-84-0
PubChem CID
12853045
DTXSID
DTXSID50511499

Properties

Computed structural properties

XLogP
4.1
Topological polar surface area
26.3 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
4
Heavy atoms
18

Physicochemical properties

Boiling point
359.3 · 359.3±21.0 °C(Predicted)
Density
1.066 · 1.066±0.06 g/cm3(Predicted)

Chemistry & industry

Suppliers2 total

Hangzhou Sage Chemical Co., Ltd.+86057186818502 13588463833 · [email protected]
珠海奥博凯生物医药技术有限公司400-0628126 · [email protected]

Related reactions

3 records

Compound notes

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