Name: Name:Benzenepentanoic acid, a,a-dimethyl-
Brand: Angene
SKU: AG01AHSK
Rating: 90 (10 reviews)

Benzenepentanoic acid, a,a-dimethyl-

CAS No.:

2840-74-6

Catalog Number:

AG01AHSK

Molecular Formula:

C13H18O2

Molecular Weight:

206.2808

Catalog Number:

AG01AHSK

Chemical Name:

Benzenepentanoic acid, a,a-dimethyl-

CAS Number:

2840-74-6

Molecular Formula:

C13H18O2

Molecular Weight:

206.2808

MDL Number:

MFCD16306543

IUPAC Name:

2,2-dimethyl-5-phenylpentanoic acid

InChI:

InChI=1S/C13H18O2/c1-13(2,12(14)15)10-6-9-11-7-4-3-5-8-11/h3-5,7-8H,6,9-10H2,1-2H3,(H,14,15)

InChI Key:

QDBSHQCJVMNTTG-UHFFFAOYSA-N

SMILES:

OC(=O)C(CCCc1ccccc1)(C)C

Complexity:

203

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

206.131g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

206.285g/mol

Monoisotopic Mass:

206.131g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

37.3A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.5