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Home > Other Building Blocks > 1988-18-7
1988-18-7 | 2-Naphthalenol, 2-formate
CAS No: 1988-18-7 Catalog No: AG002BR0 MDL No:
Product Description
Catalog Number:
AG002BR0
Chemical Name:
2-Naphthalenol, 2-formate
CAS Number:
1988-18-7
Molecular Formula:
C11H8O2
Molecular Weight:
172.1800
IUPAC Name:
naphthalen-2-yl formate
InChI:
InChI=1S/C11H8O2/c12-8-13-11-6-5-9-3-1-2-4-10(9)7-11/h1-8H
InChI Key:
ZSFLPNDWUWXOGM-UHFFFAOYSA-N
SMILES:
O=COc1ccc2c(c1)cccc2
EC Number:
217-863-6
Properties
Complexity:
179
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
172.052g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
172.183g/mol
Monoisotopic Mass:
172.052g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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