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1,3-dimethylazetidine-3-carboxylic acid

1,3-dimethylazetidine-3-carboxylic acid

CAS: 1824314-61-5

Formula: C6H11NO2

SMILES: CN1CC(C)(C1)C(O)=O

IUPAC: 1,3-dimethylazetidine-3-carboxylic acid

InChI: InChI=1S/C6H11NO2/c1-6(5(8)9)3-7(2)4-6/h3-4H2,1-2H3,(H,8,9)

Composition: C (55.80%), H (8.58%), N (10.84%), O (24.77%)

Molar Mass: 129.159

Atom Count: 20

Heavy Atom Count: 9

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 0
Exact Mass 129.078978598
Formal Charge 0
FSP3 0.83
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey FHIZSKPQPANGEV-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 33.36
Topological Polar Surface Area 40.54
Polarizability 13.12
Ring Count 1
Rotatable Bond Count 1

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