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25263-44-9

25263-44-9 | 3-Hydroxy-Benzeneacetonitrile

CAS No: 25263-44-9 Catalog No: AG00385E MDL No:MFCD03265300

Product Description

Catalog Number:
AG00385E
Chemical Name:
3-Hydroxy-Benzeneacetonitrile
CAS Number:
25263-44-9
Molecular Formula:
C8H7NO
Molecular Weight:
133.1473
MDL Number:
MFCD03265300
IUPAC Name:
2-(3-hydroxyphenyl)acetonitrile
InChI:
InChI=1S/C8H7NO/c9-5-4-7-2-1-3-8(10)6-7/h1-3,6,10H,4H2
InChI Key:
IEOUEWOHAFNQCO-UHFFFAOYSA-N
SMILES:
N#CCc1cccc(c1)O

Properties

Complexity:
147  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
133.053g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
133.15g/mol
Monoisotopic Mass:
133.053g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
44A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1  

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