200,000+ products from a single source!
sales@angenechem.com
Home > Other Building Blocks > 15872-44-3
15872-44-3 | Benzoic acid, 4-(undecyloxy)-
CAS No: 15872-44-3 Catalog No: AG001QT8 MDL No:MFCD00043772
Product Description
Catalog Number:
AG001QT8
Chemical Name:
Benzoic acid, 4-(undecyloxy)-
CAS Number:
15872-44-3
Molecular Formula:
C18H28O3
Molecular Weight:
292.4131
MDL Number:
MFCD00043772
IUPAC Name:
4-undecoxybenzoic acid
InChI:
InChI=1S/C18H28O3/c1-2-3-4-5-6-7-8-9-10-15-21-17-13-11-16(12-14-17)18(19)20/h11-14H,2-10,15H2,1H3,(H,19,20)
InChI Key:
NEJZHJHZOUISSH-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCCOc1ccc(cc1)C(=O)O
Properties
Complexity:
257
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
292.204g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
292.419g/mol
Monoisotopic Mass:
292.204g/mol
Rotatable Bond Count:
12
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.6
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.