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89005-07-2 | 1-Naphthalenecarboxaldehyde, 2-(hydroxymethyl)-
CAS No: 89005-07-2 Catalog No: AG0088VB MDL No:
Product Description
Catalog Number:
AG0088VB
Chemical Name:
1-Naphthalenecarboxaldehyde, 2-(hydroxymethyl)-
CAS Number:
89005-07-2
Molecular Formula:
C12H10O2
Molecular Weight:
186.2066
IUPAC Name:
2-(hydroxymethyl)naphthalene-1-carbaldehyde
InChI:
InChI=1S/C12H10O2/c13-7-10-6-5-9-3-1-2-4-11(9)12(10)8-14/h1-6,8,13H,7H2
InChI Key:
KAJXXQJMBGSASA-UHFFFAOYSA-N
SMILES:
O=Cc1c(CO)ccc2c1cccc2
Properties
Complexity:
203
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
186.068g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
186.21g/mol
Monoisotopic Mass:
186.068g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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