Home Nitriles 3-(1-aminocyclobutyl)benzonitrile hydrochloride

3-(1-aminocyclobutyl)benzonitrile hydrochloride

CAS No.:
1909305-81-2
Catalog Number:
AG01B1WE
Molecular Formula:
C11H13ClN2
Molecular Weight:
208.6873
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Product Description
Catalog Number:
AG01B1WE
Chemical Name:
3-(1-aminocyclobutyl)benzonitrile hydrochloride
CAS Number:
1909305-81-2
Molecular Formula:
C11H13ClN2
Molecular Weight:
208.6873
MDL Number:
MFCD29907207
IUPAC Name:
3-(1-aminocyclobutyl)benzonitrile;hydrochloride
InChI:
InChI=1S/C11H12N2.ClH/c12-8-9-3-1-4-10(7-9)11(13)5-2-6-11;/h1,3-4,7H,2,5-6,13H2;1H
InChI Key:
BTBYEHUDJFFIHM-UHFFFAOYSA-N
SMILES:
N#Cc1cccc(c1)C1(N)CCC1.Cl
Properties
Complexity:
234  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
208.077g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
208.689g/mol
Monoisotopic Mass:
208.077g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
49.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties