Home Nitriles 2-(4-hydroxyphenyl)-2-(methylamino)acetonitrile

2-(4-hydroxyphenyl)-2-(methylamino)acetonitrile

CAS No.:
1039815-62-7
Catalog Number:
AG01BRLF
Molecular Formula:
C9H10N2O
Molecular Weight:
162.1885
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Product Description
Catalog Number:
AG01BRLF
Chemical Name:
2-(4-hydroxyphenyl)-2-(methylamino)acetonitrile
CAS Number:
1039815-62-7
Molecular Formula:
C9H10N2O
Molecular Weight:
162.1885
MDL Number:
MFCD11186582
IUPAC Name:
2-(4-hydroxyphenyl)-2-(methylamino)acetonitrile
InChI:
InChI=1S/C9H10N2O/c1-11-9(6-10)7-2-4-8(12)5-3-7/h2-5,9,11-12H,1H3
InChI Key:
ATJMONHNSBVSOD-UHFFFAOYSA-N
SMILES:
CNC(c1ccc(cc1)O)C#N
Properties
Complexity:
176  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
162.079g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
162.192g/mol
Monoisotopic Mass:
162.079g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
56A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9  
Properties