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131563-72-9 | 2-Aziridinecarboxylic acid, 1-ethyl-, methyl ester, (+)-
CAS No: 131563-72-9 Catalog No: AG000ZG4 MDL No:
Product Description
Catalog Number:
AG000ZG4
Chemical Name:
2-Aziridinecarboxylic acid, 1-ethyl-, methyl ester, (+)-
CAS Number:
131563-72-9
Molecular Formula:
C6H11NO2
Molecular Weight:
129.1570
IUPAC Name:
methyl 1-ethylaziridine-2-carboxylate
InChI:
InChI=1S/C6H11NO2/c1-3-7-4-5(7)6(8)9-2/h5H,3-4H2,1-2H3
InChI Key:
UQYHRAICIBQUKW-UHFFFAOYSA-N
SMILES:
CCN1CC1C(=O)OC
Properties
Complexity:
124
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
129.079g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
129.159g/mol
Monoisotopic Mass:
129.079g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
29.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4
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