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122628-85-7

122628-85-7 | 1-Acenaphthyleneethanol

CAS No: 122628-85-7 Catalog No: AG0017K7 MDL No:

Product Description

Catalog Number:
AG0017K7
Chemical Name:
1-Acenaphthyleneethanol
CAS Number:
122628-85-7
Molecular Formula:
C14H12O
Molecular Weight:
196.2445
IUPAC Name:
2-acenaphthylen-1-ylethanol
InChI:
InChI=1S/C14H12O/c15-8-7-11-9-12-5-1-3-10-4-2-6-13(11)14(10)12/h1-6,9,15H,7-8H2
InChI Key:
DXCJNPQBJHJJAJ-UHFFFAOYSA-N
SMILES:
OCCC1=Cc2c3c1cccc3ccc2

Properties

Complexity:
269  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
196.089g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
196.249g/mol
Monoisotopic Mass:
196.089g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  

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