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26386-94-7 | Naphthalene, 2-methoxy-6-methyl-
CAS No: 26386-94-7 Catalog No: AG002SZD MDL No:
Product Description
Catalog Number:
AG002SZD
Chemical Name:
Naphthalene, 2-methoxy-6-methyl-
CAS Number:
26386-94-7
Molecular Formula:
C12H12O
Molecular Weight:
172.2231
IUPAC Name:
2-methoxy-6-methylnaphthalene
InChI:
InChI=1S/C12H12O/c1-9-3-4-11-8-12(13-2)6-5-10(11)7-9/h3-8H,1-2H3
InChI Key:
JWXYEXKKOMBZBH-UHFFFAOYSA-N
SMILES:
COc1ccc2c(c1)ccc(c2)C
Properties
Complexity:
167
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
172.089g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
172.227g/mol
Monoisotopic Mass:
172.089g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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