Text Search
Structure Search

methyl (2S)-2-[(tert-butoxycarbonyl)amino]-3-cyclopropylpropanoate

methyl (2S)-2-[(tert-butoxycarbonyl)amino]-3-cyclopropylpropanoate

CAS: 104347-84-4

Formula: C12H21NO4

SMILES: COC(=O)[C@H](CC1CC1)NC(=O)OC(C)(C)C

IUPAC: methyl (2S)-2-{[(tert-butoxy)carbonyl]amino}-3-cyclopropylpropanoate

InChI: InChI=1S/C12H21NO4/c1-12(2,3)17-11(15)13-9(10(14)16-4)7-8-5-6-8/h8-9H,5-7H2,1-4H3,(H,13,15)/t9-/m0/s1

Composition: C (59.24%), H (8.70%), N (5.76%), O (26.30%)

Molar Mass: 243.303

Atom Count: 38

Heavy Atom Count: 17

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 1
Exact Mass 243.14705816
Formal Charge 0
FSP3 0.83
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey NSBWPLARUDPFIE-VIFPVBQESA-N
Lipinski's Rule of Five 1
Molar Refractivity 62.01
Topological Polar Surface Area 64.63
Polarizability 24.82
Ring Count 1
Rotatable Bond Count 7

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Acrotein ChemBio Inc.,
Purity LeadTime CAS PacketSize UnitPrice
97% <7 Days 104347-84-4 $138.24-$620.16$138.24$207.36$620.16
Request Quote