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(2S)-4-(benzyloxy)-2-[(tert-butoxycarbonyl)amino]butanoic acid

(2S)-4-(benzyloxy)-2-[(tert-butoxycarbonyl)amino]butanoic acid

CAS: 13734-38-8

Formula: C16H23NO5

SMILES: CC(C)(C)OC(=O)N[C@@H](CCOCC1=CC=CC=C1)C(O)=O

IUPAC: (2S)-4-(benzyloxy)-2-{[(tert-butoxy)carbonyl]amino}butanoic acid

InChI: InChI=1S/C16H23NO5/c1-16(2,3)22-15(20)17-13(14(18)19)9-10-21-11-12-7-5-4-6-8-12/h4-8,13H,9-11H2,1-3H3,(H,17,20)(H,18,19)/t13-/m0/s1

Composition: C (62.12%), H (7.49%), N (4.53%), O (25.86%)

Molar Mass: 309.362

Atom Count: 45

Heavy Atom Count: 22

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 1
Exact Mass 309.157622845
Formal Charge 0
FSP3 0.5
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 2
InChIKey RFDXPGUBDAKLDM-ZDUSSCGKSA-N
Lipinski's Rule of Five 1
Molar Refractivity 81.14
Topological Polar Surface Area 84.86
Polarizability 31.89
Ring Count 1
Rotatable Bond Count 9

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Acrotein ChemBio Inc.,
Purity LeadTime CAS PacketSize UnitPrice
97% <7 Days 13734-38-8 $47.04-$592.32$47.04$164.16$592.32
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Struchem co.,ltd
Purity LeadTime CAS PacketSize UnitPrice
98% <5 Days 13734-38-8 $480.00-$1,015.00$480.00$1,015.00
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