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2026-08-6 | 1,8-Naphthalenedimethanol
CAS No: 2026-08-6 Catalog No: AG0028BW MDL No:MFCD00183549
Product Description
Catalog Number:
AG0028BW
Chemical Name:
1,8-Naphthalenedimethanol
CAS Number:
2026-08-6
Molecular Formula:
C12H12O2
Molecular Weight:
188.2225
MDL Number:
MFCD00183549
IUPAC Name:
[8-(hydroxymethyl)naphthalen-1-yl]methanol
InChI:
InChI=1S/C12H12O2/c13-7-10-5-1-3-9-4-2-6-11(8-14)12(9)10/h1-6,13-14H,7-8H2
InChI Key:
DINZUYYYXDLSJE-UHFFFAOYSA-N
SMILES:
OCc1cccc2c1c(CO)ccc2
Properties
Complexity:
163
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:
2
Isotope Atom Count:
0
Molecular Weight:
188.226g/mol
Monoisotopic Mass:
188.084g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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