Home Nitriles 2-[3-(aminomethyl)phenoxy]acetonitrile hydrochloride

2-[3-(aminomethyl)phenoxy]acetonitrile hydrochloride

CAS No.:
1306603-16-6
Catalog Number:
AG01AI3G
Molecular Formula:
C9H11ClN2O
Molecular Weight:
198.6494
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Product Description
Catalog Number:
AG01AI3G
Chemical Name:
2-[3-(aminomethyl)phenoxy]acetonitrile hydrochloride
CAS Number:
1306603-16-6
Molecular Formula:
C9H11ClN2O
Molecular Weight:
198.6494
MDL Number:
MFCD18838814
IUPAC Name:
2-[3-(aminomethyl)phenoxy]acetonitrile;hydrochloride
InChI:
InChI=1S/C9H10N2O.ClH/c10-4-5-12-9-3-1-2-8(6-9)7-11;/h1-3,6H,5,7,11H2;1H
InChI Key:
JWNFWHHDXWHZJA-UHFFFAOYSA-N
SMILES:
N#CCOc1cccc(c1)CN.Cl
Properties
Complexity:
173  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
198.056g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
198.65g/mol
Monoisotopic Mass:
198.056g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
59A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties