1-tert-butyl 3-methyl 3-aminoazetidine-1,3-dicarboxylate

1-tert-butyl 3-methyl 3-aminoazetidine-1,3-dicarboxylate

CAS: 1782647-31-7

Formula: C10H18N2O4

SMILES: COC(=O)C1(N)CN(C1)C(=O)OC(C)(C)C

IUPAC: 1-tert-butyl 3-methyl 3-aminoazetidine-1,3-dicarboxylate

InChI: InChI=1S/C10H18N2O4/c1-9(2,3)16-8(14)12-5-10(11,6-12)7(13)15-4/h5-6,11H2,1-4H3

Composition: C (52.16%), H (7.88%), N (12.17%), O (27.79%)

Molar Mass: 230.264

Atom Count: 34

Heavy Atom Count: 16

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	0
Exact Mass	230.126657068
Formal Charge	0
FSP3	0.8
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	BINCCFKDJYPIFA-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	56.23
Topological Polar Surface Area	81.86
Polarizability	22.7
Ring Count	1
Rotatable Bond Count	4

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