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626-34-6 | (Z)-Ethyl 3-aminobut-2-enoate
CAS No: 626-34-6 Catalog No: AG003Q75 MDL No:MFCD00008073
Product Description
Catalog Number:
AG003Q75
Chemical Name:
(Z)-Ethyl 3-aminobut-2-enoate
CAS Number:
626-34-6
Molecular Formula:
C6H11NO2
Molecular Weight:
129.1570
MDL Number:
MFCD00008073
IUPAC Name:
ethyl (Z)-3-aminobut-2-enoate
InChI:
InChI=1S/C6H11NO2/c1-3-9-6(8)4-5(2)7/h4H,3,7H2,1-2H3/b5-4-
InChI Key:
YPMPTULBFPFSEQ-PLNGDYQASA-N
SMILES:
CCOC(=O)/C=C(\N)/C
EC Number:
230-782-0
NSC Number:
1086
Properties
Complexity:
129
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
129.079g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
129.159g/mol
Monoisotopic Mass:
129.079g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
52.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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