CC(C)C(C)(C#N)N
CAS: 13893-53-3
Name: 2-amino-2,3-dimethylbutanenitrile
SMILES: CC(C)C(C)(C#N)N

Molecular Processing

Molecular formula
C6H12N2
Molecular weight
112.18
Exact mass
112.1
XLogP
0.88
TPSA
49.81
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
1
Heavy atoms
8
Rings
0
Aromatic rings
0
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.833
Molar refractivity
33.04

Supplementary Information

InChIKey: CAOHBROWLMCZRP-UHFFFAOYSA-N
Synonyms
2-Amino-2,3-dimethylbutanenitrile13893-53-32-Amino-2,3-dimethylbutyronitrileButanenitrile, 2-amino-2,3-dimethyl-DTXSID2027759AC-9414905V56HJZ5FDTXCID207759EC 604-102-1AC 94149RefChem:463314(+-)-2-AMINO-2-CYANO-3-METHYLBUTANE604-102-1MFCD006618642-Amino-2,3-dimethylbutanenitrile (>90%)UNII-05V56HJZ5FButanenitrile, 2-amino-2,3-dimethyl-, (+)-(+/-)-2-Amino-2,3-dimethylbutyronitrile; (+/-)-2-Amino-2-cyano-3-methylbutane; 2-Amino-2,3-dimethylbutyronitrile; AC 94149SCHEMBL812803CHEMBL31823031,2-dimethyl-1-cyanopropylamine1-cyano-1,2-dimethylpropylamine2-Amino-23-dimethylbutanenitrileHMS1788G192-amino-2,3-dimethyl-butanenitrileTox21_302196SBB066047AKOS000118705AKOS016842345CS-W021542
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Involved in 41 reactions→

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