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68843-72-1

68843-72-1 | 4-Pentenoic acid, 2-amino-, ethyl ester

CAS No: 68843-72-1 Catalog No: AG006GHQ MDL No:MFCD19661179

Product Description

Catalog Number:
AG006GHQ
Chemical Name:
4-Pentenoic acid, 2-amino-, ethyl ester
CAS Number:
68843-72-1
Molecular Formula:
C7H13NO2
Molecular Weight:
143.1836
MDL Number:
MFCD19661179
IUPAC Name:
ethyl 2-aminopent-4-enoate
InChI:
InChI=1S/C7H13NO2/c1-3-5-6(8)7(9)10-4-2/h3,6H,1,4-5,8H2,2H3
InChI Key:
LDRBRYURDQQPMN-UHFFFAOYSA-N
SMILES:
CCOC(=O)C(CC=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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