benzyl (1s,3s)-3-hydroxycyclobutane-1-carboxylate

benzyl (1s,3s)-3-hydroxycyclobutane-1-carboxylate

CAS: 552849-32-8

Formula: C12H14O3

SMILES: O[C@H]1C[C@H](C1)C(=O)OCC1=CC=CC=C1

IUPAC: benzyl (1s,3s)-3-hydroxycyclobutane-1-carboxylate

InChI: InChI=1/C12H14O3/c13-11-6-10(7-11)12(14)15-8-9-4-2-1-3-5-9/h1-5,10-11,13H,6-8H2/t10-,11+

Composition: C (69.89%), H (6.84%), O (23.27%)

Molar Mass: 206.241

Atom Count: 29

Heavy Atom Count: 15

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	206.094294311
Formal Charge	0
FSP3	0.42
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	XNZBUAFOVHWZNQ-PHIMTYICNA-N
Lipinski's Rule of Five	1
Molar Refractivity	55.7
Topological Polar Surface Area	46.53
Polarizability	22.03
Ring Count	2
Rotatable Bond Count	4

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Purity	LeadTime	CAS	PacketSize	UnitPrice
97%	<5 Days	552849-32-8		$83.23-$1,890.24$83.23$165.19$175.28$547.27$944.49$1,890.24