Name: Name:Benzenepropanoicacid,3,5-bis(1,1-diMethyl-ethyl)-44hydroxy-C7-C9branchedalkylesters
Brand: Angene
SKU: AG00G4S7
Rating: 90 (10 reviews)

Benzenepropanoicacid,3,5-bis(1,1-diMethyl-ethyl)-44hydroxy-C7-C9branchedalkylesters

CAS No.:

847488-62-4

Catalog Number:

AG00G4S7

Molecular Formula:

C30H52O3

Molecular Weight:

460.7321

Catalog Number:

AG00G4S7

Chemical Name:

Benzenepropanoicacid,3,5-bis(1,1-diMethyl-ethyl)-44hydroxy-C7-C9branchedalkylesters

CAS Number:

847488-62-4

Molecular Formula:

C30H52O3

Molecular Weight:

460.7321

MDL Number:

MFCD31629688

IUPAC Name:

11-methyldodecyl 3-(3,5-ditert-butyl-4-hydroxyphenyl)propanoate

InChI:

InChI=1S/C30H52O3/c1-23(2)17-15-13-11-9-10-12-14-16-20-33-27(31)19-18-24-21-25(29(3,4)5)28(32)26(22-24)30(6,7)8/h21-23,32H,9-20H2,1-8H3

InChI Key:

OLGBEZPVDGIRFI-UHFFFAOYSA-N

SMILES:

CC(CCCCCCCCCCOC(=O)CCc1cc(c(c(c1)C(C)(C)C)O)C(C)(C)C)C

EC Number:

700-397-7

Complexity:

502

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

460.392g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

460.743g/mol

Monoisotopic Mass:

460.392g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

46.5A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

10.8