Home Aminos 3-(aminomethyl)-N-(butan-2-yl)benzamide

3-(aminomethyl)-N-(butan-2-yl)benzamide

CAS No.:
926229-91-6
Catalog Number:
AG019UP1
Molecular Formula:
C12H18N2O
Molecular Weight:
206.2841
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Product Description
Catalog Number:
AG019UP1
Chemical Name:
3-(aminomethyl)-N-(butan-2-yl)benzamide
CAS Number:
926229-91-6
Molecular Formula:
C12H18N2O
Molecular Weight:
206.2841
MDL Number:
MFCD09050791
IUPAC Name:
3-(aminomethyl)-N-butan-2-ylbenzamide
InChI:
InChI=1S/C12H18N2O/c1-3-9(2)14-12(15)11-6-4-5-10(7-11)8-13/h4-7,9H,3,8,13H2,1-2H3,(H,14,15)
InChI Key:
UGXANNZSHQYPTI-UHFFFAOYSA-N
SMILES:
CCC(NC(=O)c1cccc(c1)CN)C
Properties
Complexity:
206  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
206.142g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
206.289g/mol
Monoisotopic Mass:
206.142g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
55.1A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  
Properties