2-{[(benzyloxy)carbonyl]amino}-4-hydroxybutanoic acid

2-{[(benzyloxy)carbonyl]amino}-4-hydroxybutanoic acid

Formula: C12H15NO5

SMILES: OCCC(NC(=O)OCC1=CC=CC=C1)C(O)=O

IUPAC: 2-{[(benzyloxy)carbonyl]amino}-4-hydroxybutanoic acid

InChI: InChI=1/C12H15NO5/c14-7-6-10(11(15)16)13-12(17)18-8-9-4-2-1-3-5-9/h1-5,10,14H,6-8H2,(H,13,17)(H,15,16)

Composition: C (56.91%), H (5.97%), N (5.53%), O (31.59%)

Molar Mass: 253.254

Atom Count: 33

Heavy Atom Count: 18

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	1
Exact Mass	253.095022587
Formal Charge	0
FSP3	0.33
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	3
InChIKey	UBXPAGGJJMSWLC-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	62.59
Topological Polar Surface Area	95.86
Polarizability	24.5
Ring Count	1
Rotatable Bond Count	7

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Purity	LeadTime	Formula		UnitPrice
98%	<10 Days	C12H15NO5		Quote Only