Methyl 2- (4-biphenylyl) propionate

CAT: 0926-ZCA64799-01Size: 500 mgDry Ice: NoHazardous: No

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CAT#:0926-ZCA64799-01Size:500 mg

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CAS Number

74647-99-7

Smiles

CC (C1=CC=C (C=C1) C2=CC=CC=C2) C (=O) OC

Molecular Formula

C16H16O2

Molecular Weight

240.3 g/mol

Controlled

Chemical Information

alpha-Methylbiphenyl-4-acetic acid methyl ester

CAS Number	74647-99-7
PubChem CID	10911650
IUPAC Name	methyl 2-(4-phenylphenyl)propanoate
Molecular Formula	C16H16O2
Molecular Weight	240.30
XLogP	3.9
Topological Polar Surface Area	26.3
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	4
Heavy Atom Count	18
Formal Charge	0
Complexity	260

SMILES

CC(C1=CC=C(C=C1)C2=CC=CC=C2)C(=O)OC

InChI

InChI=1S/C16H16O2/c1-12(16(17)18-2)13-8-10-15(11-9-13)14-6-4-3-5-7-14/h3-12H,1-2H3

InChIKey

SVAIHUDRBSNKFR-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 74647-99-7

CID: 10911650

Formula: C16H16O2

MW: 240.30

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	240.30
XLogP3	3.9
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	4
Exact Mass	240.115029749
Monoisotopic Mass	240.115029749
Topological Polar Surface Area	26.3 Å²
Heavy Atom Count	18
Formal Charge	0
Complexity	260
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
FA23508-01	1-Acetoxyethyl 2- (2-fluoro-4-biphenylyl) propionate
IWB95892-01	Methyl 2-[methyl (4-pyridinyl) carbamothioylthio]propionate
FM37167-01	Methyl 3- (4-hydroxyphenyl) propionate
JBA35274-01	2- (4-Biphenylyl) -2-propanol
QFA45138-01	Methyl 2- (3-formylphenoxy) propionate
ACA42765-01	Methyl 2-formyl-3-oxo-propionate
FS35587-01	Sodium 2- (4-Methoxyphenoxy) propionate
FP70595-01	Potassium 2- (4-hydroxyphenoxy) propionate
FB147045-01	2-Biphenylyl glycidylether
DEB03963	4'-Bromotri (4-biphenylyl) amine

Catalog	Name
454732-01	Methyl 2- (4-biphenylyl) propionate
M296310	Methyl 2-(4-biphenylyl)propionate
TRC-M312945-1G	Methyl 2-(4-Hydroxyphenoxy)propionate
abx184191-01	Methyl 3-(4-hydroxyphenyl)propionate
sc-228518	Methyl 3- (4-methoxyphenyl) propionate
454743	Methyl 2- (4-Hydroxyphenoxy) propionate
sc-295412A	Methyl 3- (4-boronobenzamido) propionate
sc-486961	Methyl 3- (4-Methoxycarbonylphenyl) propionate
T65069	Methyl 3- (4-hydroxyphenyl) propionate
M3501-20	Methyl 3- (Imidazol-4-yl) Propionate