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190783-99-4 | Proline, 1-methyl-5-oxo-, methyl ester
CAS No: 190783-99-4 Catalog No: AG002ET5 MDL No:MFCD12026428
Product Description
Catalog Number:
AG002ET5
Chemical Name:
Proline, 1-methyl-5-oxo-, methyl ester
CAS Number:
190783-99-4
Molecular Formula:
C7H11NO3
Molecular Weight:
157.1671
MDL Number:
MFCD12026428
IUPAC Name:
methyl 1-methyl-5-oxopyrrolidine-2-carboxylate
InChI:
InChI=1S/C7H11NO3/c1-8-5(7(10)11-2)3-4-6(8)9/h5H,3-4H2,1-2H3
InChI Key:
ABAOXDQXQHQRFA-UHFFFAOYSA-N
SMILES:
CN1[C@@H](CCC1=O)C(=O)OC
Properties
Complexity:
190
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
157.074g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
157.169g/mol
Monoisotopic Mass:
157.074g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
46.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.3
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