200,000+ products from a single source!
sales@angenechem.com
88144-77-8 | 2-({[2-(carboxymethyl)-4-hydroxyhexyl]oxy}carbonyl)benzoic acid
CAS No: 88144-77-8 Catalog No: AG004D8J MDL No:
Product Description
Catalog Number:
AG004D8J
Chemical Name:
2-({[2-(carboxymethyl)-4-hydroxyhexyl]oxy}carbonyl)benzoic acid
CAS Number:
88144-77-8
Molecular Formula:
C16H20O7
Molecular Weight:
324.3258
IUPAC Name:
2-[2-(carboxymethyl)-4-hydroxyhexoxy]carbonylbenzoic acid
InChI:
InChI=1S/C16H20O7/c1-2-11(17)7-10(8-14(18)19)9-23-16(22)13-6-4-3-5-12(13)15(20)21/h3-6,10-11,17H,2,7-9H2,1H3,(H,18,19)(H,20,21)
InChI Key:
QKQZCNYGVKEIML-UHFFFAOYSA-N
SMILES:
CCC(CC(CC(=O)O)COC(=O)c1ccccc1C(=O)O)O
Properties
Complexity:
421
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
324.121g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
324.329g/mol
Monoisotopic Mass:
324.121g/mol
Rotatable Bond Count:
10
Topological Polar Surface Area:
121A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.