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175841-32-4 | 1-Naphthalenol, 2,5-dimethyl-
CAS No: 175841-32-4 Catalog No: AG00217U MDL No:
Product Description
Catalog Number:
AG00217U
Chemical Name:
1-Naphthalenol, 2,5-dimethyl-
CAS Number:
175841-32-4
Molecular Formula:
C12H12O
Molecular Weight:
172.2231
IUPAC Name:
2,5-dimethylnaphthalen-1-ol
InChI:
InChI=1S/C12H12O/c1-8-4-3-5-11-10(8)7-6-9(2)12(11)13/h3-7,13H,1-2H3
InChI Key:
WHWZJCKKJVJWBH-UHFFFAOYSA-N
SMILES:
Cc1ccc2c(c1O)cccc2C
Properties
Complexity:
178
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:
1
Isotope Atom Count:
0
Molecular Weight:
172.227g/mol
Monoisotopic Mass:
172.089g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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