tert-butyl N-(3-chloro-2-oxopropyl)carbamate

tert-butyl N-(3-chloro-2-oxopropyl)carbamate

CAS: 137990-82-0

Formula: C8H14ClNO3

SMILES: CC(C)(C)OC(=O)NCC(=O)CCl

IUPAC: tert-butyl N-(3-chloro-2-oxopropyl)carbamate

InChI: InChI=1S/C8H14ClNO3/c1-8(2,3)13-7(12)10-5-6(11)4-9/h4-5H2,1-3H3,(H,10,12)

Composition: C (46.27%), H (6.80%), Cl (17.07%), N (6.75%), O (23.11%)

Molar Mass: 207.65

Atom Count: 27

Heavy Atom Count: 13

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	0
Exact Mass	207.066221
Formal Charge	0
FSP3	0.75
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	UCZJERMRQOJXHU-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	49.18
Topological Polar Surface Area	55.4
Polarizability	19.39
Ring Count	0
Rotatable Bond Count	5

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