200,000+ products from a single source!
sales@angenechem.com
Home > Nitro Compounds > 88127-48-4
88127-48-4 | Octadecanoic acid, 9-hydroxy-10-nitro-
CAS No: 88127-48-4 Catalog No: AG004DUN MDL No:
Product Description
Catalog Number:
AG004DUN
Chemical Name:
Octadecanoic acid, 9-hydroxy-10-nitro-
CAS Number:
88127-48-4
Molecular Formula:
C18H35NO5
Molecular Weight:
345.4742
IUPAC Name:
9-hydroxy-10-nitrooctadecanoic acid
InChI:
InChI=1S/C18H35NO5/c1-2-3-4-5-7-10-13-16(19(23)24)17(20)14-11-8-6-9-12-15-18(21)22/h16-17,20H,2-15H2,1H3,(H,21,22)
InChI Key:
HTHBLMOFSNPJLE-UHFFFAOYSA-N
SMILES:
CCCCCCCCC(C(CCCCCCCC(=O)O)O)[N+](=O)[O-]
Properties
Complexity:
330
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
345.252g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
345.48g/mol
Monoisotopic Mass:
345.252g/mol
Rotatable Bond Count:
16
Topological Polar Surface Area:
103A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
5.6
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.