1-benzoylazetidine-3-carboxylic acid

1-benzoylazetidine-3-carboxylic acid

CAS: 97639-63-9

Formula: C11H11NO3

SMILES: OC(=O)C1CN(C1)C(=O)C1=CC=CC=C1

IUPAC: 1-benzoylazetidine-3-carboxylic acid

InChI: InChI=1S/C11H11NO3/c13-10(8-4-2-1-3-5-8)12-6-9(7-12)11(14)15/h1-5,9H,6-7H2,(H,14,15)

Composition: C (64.38%), H (5.40%), N (6.83%), O (23.39%)

Molar Mass: 205.213

Atom Count: 26

Heavy Atom Count: 15

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	205.073893218
Formal Charge	0
FSP3	0.27
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	ZJMHNHJCFPFOSG-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	53.8
Topological Polar Surface Area	57.61
Polarizability	20.35
Ring Count	2
Rotatable Bond Count	2

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Purity	LeadTime	CAS	PacketSize	UnitPrice
95%	<5 Days	97639-63-9		$2,200.00-$3,740.00$2,200.00$2,860.00$3,740.00