Name: Name:2-[(3-bromophenyl)methyl]-7-hydroxyheptanoic acid
Brand: Angene
SKU: AG01ELAD
Rating: 90 (10 reviews)

2-[(3-bromophenyl)methyl]-7-hydroxyheptanoic acid

CAS No.:

1505000-71-4

Catalog Number:

AG01ELAD

Molecular Formula:

C14H19BrO3

Molecular Weight:

315.2029

Catalog Number:

AG01ELAD

Chemical Name:

2-[(3-bromophenyl)methyl]-7-hydroxyheptanoic acid

CAS Number:

1505000-71-4

Molecular Formula:

C14H19BrO3

Molecular Weight:

315.2029

MDL Number:

MFCD24878824

IUPAC Name:

2-[(3-bromophenyl)methyl]-7-hydroxyheptanoic acid

InChI:

InChI=1S/C14H19BrO3/c15-13-7-4-5-11(10-13)9-12(14(17)18)6-2-1-3-8-16/h4-5,7,10,12,16H,1-3,6,8-9H2,(H,17,18)

InChI Key:

PAOOPFYJVONYLH-UHFFFAOYSA-N

SMILES:

OCCCCCC(C(=O)O)Cc1cccc(c1)Br

Complexity:

245

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

314.052g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

315.207g/mol

Monoisotopic Mass:

314.052g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

57.5A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.3