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14233-73-9 | 1-Naphthalenepropanenitrile,2-hydroxy-
CAS No: 14233-73-9 Catalog No: AG006UOG MDL No:MFCD10037626
Product Description
Catalog Number:
AG006UOG
Chemical Name:
1-Naphthalenepropanenitrile,2-hydroxy-
CAS Number:
14233-73-9
Molecular Formula:
C13H11NO
Molecular Weight:
197.2325
MDL Number:
MFCD10037626
IUPAC Name:
3-(2-hydroxynaphthalen-1-yl)propanenitrile
InChI:
InChI=1S/C13H11NO/c14-9-3-6-12-11-5-2-1-4-10(11)7-8-13(12)15/h1-2,4-5,7-8,15H,3,6H2
InChI Key:
KMFUGGDHCILVAX-UHFFFAOYSA-N
SMILES:
N#CCCc1c(O)ccc2c1cccc2
NSC Number:
6904
Properties
Complexity:
255
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
197.084g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
197.237g/mol
Monoisotopic Mass:
197.084g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
44A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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