Name: Name:Benzoic acid, 2-hydroxy-, 1,1'-[(1-methylethylidene)di-4,1-phenylene] ester
Brand: Angene
SKU: AG001W1U
Rating: 90 (10 reviews)

Benzoic acid, 2-hydroxy-, 1,1'-[(1-methylethylidene)di-4,1-phenylene] ester

CAS No.:

16527-05-2

Catalog Number:

AG001W1U

Molecular Formula:

C29H24O6

Molecular Weight:

468.4973

Catalog Number:

AG001W1U

Chemical Name:

Benzoic acid, 2-hydroxy-, 1,1'-[(1-methylethylidene)di-4,1-phenylene] ester

CAS Number:

16527-05-2

Molecular Formula:

C29H24O6

Molecular Weight:

468.4973

MDL Number:

MFCD29918514

IUPAC Name:

[4-[2-[4-(2-hydroxybenzoyl)oxyphenyl]propan-2-yl]phenyl] 2-hydroxybenzoate

InChI:

InChI=1S/C29H24O6/c1-29(2,19-11-15-21(16-12-19)34-27(32)23-7-3-5-9-25(23)30)20-13-17-22(18-14-20)35-28(33)24-8-4-6-10-26(24)31/h3-18,30-31H,1-2H3

InChI Key:

HEIPCDMHAQLHKV-UHFFFAOYSA-N

SMILES:

O=C(c1ccccc1O)Oc1ccc(cc1)C(c1ccc(cc1)OC(=O)c1ccccc1O)(C)C

NSC Number:

73184

Complexity:

646

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

468.157g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

468.505g/mol

Monoisotopic Mass:

468.157g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

93.1A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

7.9