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674786-04-0

674786-04-0 | 2-Propenoic acid, 2-aminobutyl ester

CAS No: 674786-04-0 Catalog No: AG006G8T MDL No:

Product Description

Catalog Number:
AG006G8T
Chemical Name:
2-Propenoic acid, 2-aminobutyl ester
CAS Number:
674786-04-0
Molecular Formula:
C7H13NO2
Molecular Weight:
143.1836
IUPAC Name:
2-aminobutyl prop-2-enoate
InChI:
InChI=1S/C7H13NO2/c1-3-6(8)5-10-7(9)4-2/h4,6H,2-3,5,8H2,1H3
InChI Key:
XBFYOGLPJXLVMZ-UHFFFAOYSA-N
SMILES:
CCC(COC(=O)C=C)N

Properties

Complexity:
123  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
143.095g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
143.186g/mol
Monoisotopic Mass:
143.095g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
52.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7  

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