1-benzyl 3-methyl 3-hydroxyazetidine-1,3-dicarboxylate

1-benzyl 3-methyl 3-hydroxyazetidine-1,3-dicarboxylate

CAS: 1884493-20-2

Formula: C13H15NO5

SMILES: COC(=O)C1(O)CN(C1)C(=O)OCC1=CC=CC=C1

IUPAC: 1-benzyl 3-methyl 3-hydroxyazetidine-1,3-dicarboxylate

InChI: InChI=1S/C13H15NO5/c1-18-11(15)13(17)8-14(9-13)12(16)19-7-10-5-3-2-4-6-10/h2-6,17H,7-9H2,1H3

Composition: C (58.86%), H (5.70%), N (5.28%), O (30.16%)

Molar Mass: 265.265

Atom Count: 34

Heavy Atom Count: 19

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	265.095022587
Formal Charge	0
FSP3	0.38
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	RIKKXEORXDOEJL-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	65.38
Topological Polar Surface Area	76.07
Polarizability	25.86
Ring Count	2
Rotatable Bond Count	5

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