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141870-95-3 | 1,2-Pyrrolidinedicarboxylic acid, 2-methyl-, 2-methyl 1-(phenylmethyl) ester
CAS No: 141870-95-3 Catalog No: AG001H9X MDL No:MFCD23701515
Product Description
Catalog Number:
AG001H9X
Chemical Name:
1,2-Pyrrolidinedicarboxylic acid, 2-methyl-, 2-methyl 1-(phenylmethyl) ester
CAS Number:
141870-95-3
Molecular Formula:
C15H19NO4
Molecular Weight:
277.3157
MDL Number:
MFCD23701515
IUPAC Name:
1-O-benzyl 2-O-methyl 2-methylpyrrolidine-1,2-dicarboxylate
InChI:
InChI=1S/C15H19NO4/c1-15(13(17)19-2)9-6-10-16(15)14(18)20-11-12-7-4-3-5-8-12/h3-5,7-8H,6,9-11H2,1-2H3
InChI Key:
UUZYJNOJPVEUBY-UHFFFAOYSA-N
SMILES:
COC(=O)C1(C)CCCN1C(=O)OCc1ccccc1
Properties
Complexity:
365
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
277.131g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
277.32g/mol
Monoisotopic Mass:
277.131g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
55.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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