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786641-12-1

786641-12-1 | Acetamide, N-(4-amino-2-butynyl)-

CAS No: 786641-12-1 Catalog No: AG005K0H MDL No:

Product Description

Catalog Number:
AG005K0H
Chemical Name:
Acetamide, N-(4-amino-2-butynyl)-
CAS Number:
786641-12-1
Molecular Formula:
C6H10N2O
Molecular Weight:
126.1564
IUPAC Name:
N-(4-aminobut-2-ynyl)acetamide
InChI:
InChI=1S/C6H10N2O/c1-6(9)8-5-3-2-4-7/h4-5,7H2,1H3,(H,8,9)
InChI Key:
QZUGFHFAXRKYCF-UHFFFAOYSA-N
SMILES:
CC(=O)NCC#CCN

Properties

Complexity:
151  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
126.079g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
126.159g/mol
Monoisotopic Mass:
126.079g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
55.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.3  

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