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57276-65-0 | 2-(2-Aminoethoxy);benzonitrile
CAS No: 57276-65-0 Catalog No: AG003EQR MDL No:MFCD16495889
Product Description
Catalog Number:
AG003EQR
Chemical Name:
2-(2-Aminoethoxy);benzonitrile
CAS Number:
57276-65-0
Molecular Formula:
C9H10N2O
Molecular Weight:
162.1885
MDL Number:
MFCD16495889
IUPAC Name:
2-(2-aminoethoxy)benzonitrile
InChI:
InChI=1S/C9H10N2O/c10-5-6-12-9-4-2-1-3-8(9)7-11/h1-4H,5-6,10H2
InChI Key:
IQOAHZWDAUBPNR-UHFFFAOYSA-N
SMILES:
NCCOc1ccccc1C#N
Properties
Complexity:
173
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:
1
Isotope Atom Count:
0
Molecular Weight:
162.192g/mol
Monoisotopic Mass:
162.079g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
59A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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