Home Nitriles 2-amino-4-(propan-2-yloxy)butanenitrile hydrochloride

2-amino-4-(propan-2-yloxy)butanenitrile hydrochloride

CAS No.:
1803592-40-6
Catalog Number:
AG01AFPS
Molecular Formula:
C7H15ClN2O
Molecular Weight:
178.6598
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Product Description
Catalog Number:
AG01AFPS
Chemical Name:
2-amino-4-(propan-2-yloxy)butanenitrile hydrochloride
CAS Number:
1803592-40-6
Molecular Formula:
C7H15ClN2O
Molecular Weight:
178.6598
MDL Number:
MFCD27500963
IUPAC Name:
2-amino-4-propan-2-yloxybutanenitrile;hydrochloride
InChI:
InChI=1S/C7H14N2O.ClH/c1-6(2)10-4-3-7(9)5-8;/h6-7H,3-4,9H2,1-2H3;1H
InChI Key:
TVJJMUORXRNYFH-UHFFFAOYSA-N
SMILES:
N#CC(CCOC(C)C)N.Cl
Properties
Complexity:
125  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
178.087g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
178.66g/mol
Monoisotopic Mass:
178.087g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
59A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties