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Home > Nitro Compounds > 180977-37-1
180977-37-1 | Benzoic acid, 2-(1-naphthalenyl)-4-nitro-
CAS No: 180977-37-1 Catalog No: AG00I0AO MDL No:
Product Description
Catalog Number:
AG00I0AO
Chemical Name:
Benzoic acid, 2-(1-naphthalenyl)-4-nitro-
CAS Number:
180977-37-1
IUPAC Name:
2-naphthalen-1-yl-4-nitrobenzoic acid
InChI:
InChI=1S/C17H11NO4/c19-17(20)15-9-8-12(18(21)22)10-16(15)14-7-3-5-11-4-1-2-6-13(11)14/h1-10H,(H,19,20)
InChI Key:
WRDIZLRYLLRKEM-UHFFFAOYSA-N
Properties
Complexity:
433
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
293.069g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
293.278g/mol
Monoisotopic Mass:
293.069g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
83.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2
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