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10075-61-3 | Naphthalene, 1,3-dimethoxy-
CAS No: 10075-61-3 Catalog No: AG0002SE MDL No:MFCD00980804
Product Description
Catalog Number:
AG0002SE
Chemical Name:
Naphthalene, 1,3-dimethoxy-
CAS Number:
10075-61-3
Molecular Formula:
C12H12O2
Molecular Weight:
188.2225
MDL Number:
MFCD00980804
IUPAC Name:
1,3-dimethoxynaphthalene
InChI:
InChI=1S/C12H12O2/c1-13-10-7-9-5-3-4-6-11(9)12(8-10)14-2/h3-8H,1-2H3
InChI Key:
XAVOEDQPSYWNHI-UHFFFAOYSA-N
SMILES:
COc1cc(OC)cc2c1cccc2
Properties
Complexity:
181
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
188.084g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
188.226g/mol
Monoisotopic Mass:
188.084g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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