Home Amines 1273996-18-1
1273996-18-1,MFCD16286125
Catalog No.:AA01A2OH

1273996-18-1 | 1-(4-methylphenyl)-1-(1H-1,2,4-triazol-1-yl)butan-2-amine

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Technical Information
Catalog Number:
AA01A2OH
Chemical Name:
1-(4-methylphenyl)-1-(1H-1,2,4-triazol-1-yl)butan-2-amine
CAS Number:
1273996-18-1
Molecular Formula:
C13H18N4
Molecular Weight:
230.3088
MDL Number:
MFCD16286125
SMILES:
CCC(C(n1cncn1)c1ccc(cc1)C)N
Properties
Computed Properties
 
Complexity:
226  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
4  
Undefined Atom Stereocenter Count:
2  
XLogP3:
2  

Literature
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SDS
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Tags:1273996-18-1 Molecular Formula|1273996-18-1 MDL|1273996-18-1 SMILES|1273996-18-1 1-(4-methylphenyl)-1-(1H-1,2,4-triazol-1-yl)butan-2-amine