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23614-99-5 | 1-Aziridinecarboxylic acid, 2-methyl-, oxydi-2,1-ethanediyl ester (9CI)
CAS No: 23614-99-5 Catalog No: AG002NW8 MDL No:
Product Description
Catalog Number:
AG002NW8
Chemical Name:
1-Aziridinecarboxylic acid, 2-methyl-, oxydi-2,1-ethanediyl ester (9CI)
CAS Number:
23614-99-5
Molecular Formula:
C12H20N2O5
Molecular Weight:
272.2976
IUPAC Name:
2-[2-(2-methylaziridine-1-carbonyl)oxyethoxy]ethyl 2-methylaziridine-1-carboxylate
InChI:
InChI=1S/C12H20N2O5/c1-9-7-13(9)11(15)18-5-3-17-4-6-19-12(16)14-8-10(14)2/h9-10H,3-8H2,1-2H3
InChI Key:
SPMJQNSNCJNFFL-UHFFFAOYSA-N
SMILES:
CC1CN1C(=O)OCCOCCOC(=O)N1CC1C
NSC Number:
57569
Properties
Complexity:
317
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
272.137g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
272.301g/mol
Monoisotopic Mass:
272.137g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
67.8A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3
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