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69395-13-7

69395-13-7 | 4-(2-Hydroxyethyl)Benzonitrile

CAS No: 69395-13-7 Catalog No: AG0038HK MDL No:MFCD00052461

Product Description

Catalog Number:
AG0038HK
Chemical Name:
4-(2-Hydroxyethyl)Benzonitrile
CAS Number:
69395-13-7
Molecular Formula:
C9H9NO
Molecular Weight:
147.1739
MDL Number:
MFCD00052461
IUPAC Name:
4-(2-hydroxyethyl)benzonitrile
InChI:
InChI=1S/C9H9NO/c10-7-9-3-1-8(2-4-9)5-6-11/h1-4,11H,5-6H2
InChI Key:
RBSJBNYPTGMZIH-UHFFFAOYSA-N
SMILES:
OCCc1ccc(cc1)C#N

Properties

Complexity:
150  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
147.068g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
147.177g/mol
Monoisotopic Mass:
147.068g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
44A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5  

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