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chloromethyl 3-[(tert-butoxycarbonyl)amino]propanoate

chloromethyl 3-[(tert-butoxycarbonyl)amino]propanoate

CAS: 150109-41-4

Formula: C9H16ClNO4

SMILES: CC(C)(C)OC(=O)NCCC(=O)OCCl

IUPAC: chloromethyl 3-{[(tert-butoxy)carbonyl]amino}propanoate

InChI: InChI=1S/C9H16ClNO4/c1-9(2,3)15-8(13)11-5-4-7(12)14-6-10/h4-6H2,1-3H3,(H,11,13)

Composition: C (45.48%), H (6.79%), Cl (14.92%), N (5.89%), O (26.93%)

Molar Mass: 237.68

Atom Count: 31

Heavy Atom Count: 15

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 0
Exact Mass 237.0767857
Formal Charge 0
FSP3 0.78
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey WONDONZVEYHOOG-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 54.98
Topological Polar Surface Area 64.63
Polarizability 21.97
Ring Count 0
Rotatable Bond Count 7

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Purity (%)
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Purity LeadTime CAS UnitPrice
98% <10 Days 150109-41-4 Quote Only
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Purity LeadTime CAS PacketSize UnitPrice
95% <5 Days 150109-41-4 $23.96-$107.19$23.96$40.35$107.19
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