200,000+ products from a single source!
sales@angenechem.com
Home > Other Building Blocks > 16357-40-7
16357-40-7 | Benzoic acid, 3-acetyl-4-hydroxy-
CAS No: 16357-40-7 Catalog No: AG001U8T MDL No:MFCD00532680
Product Description
Catalog Number:
AG001U8T
Chemical Name:
Benzoic acid, 3-acetyl-4-hydroxy-
CAS Number:
16357-40-7
Molecular Formula:
C9H8O4
Molecular Weight:
180.1574
MDL Number:
MFCD00532680
IUPAC Name:
3-acetyl-4-hydroxybenzoic acid
InChI:
InChI=1S/C9H8O4/c1-5(10)7-4-6(9(12)13)2-3-8(7)11/h2-4,11H,1H3,(H,12,13)
InChI Key:
FPBXWXGOFQSROI-UHFFFAOYSA-N
SMILES:
OC(=O)c1ccc(c(c1)C(=O)C)O
Properties
Complexity:
224
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
180.042g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
180.159g/mol
Monoisotopic Mass:
180.042g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
74.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.