tert-butyl N-(4-chloro-1,3-thiazol-2-yl)carbamate

tert-butyl N-(4-chloro-1,3-thiazol-2-yl)carbamate

CAS: 1373223-09-6

Formula: C8H11ClN2O2S

SMILES: CC(C)(C)OC(=O)NC1=NC(Cl)=CS1

IUPAC: tert-butyl N-(4-chloro-1,3-thiazol-2-yl)carbamate

InChI: InChI=1S/C8H11ClN2O2S/c1-8(2,3)13-7(12)11-6-10-5(9)4-14-6/h4H,1-3H3,(H,10,11,12)

Composition: C (40.94%), H (4.72%), Cl (15.10%), N (11.94%), O (13.63%), S (13.66%)

Molar Mass: 234.7

Atom Count: 25

Heavy Atom Count: 14

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	234.0229765
Formal Charge	0
FSP3	0.5
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	RRRSEOPYCBAJKC-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	56.9
Topological Polar Surface Area	51.22
Polarizability	21.31
Ring Count	1
Rotatable Bond Count	3

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