2-(chloromethyl)-5-methyl-1,3,4-thiadiazole

2-(chloromethyl)-5-methyl-1,3,4-thiadiazole

CAS: 75341-23-0

Formula: C4H5ClN2S

SMILES: CC1=NN=C(CCl)S1

IUPAC: 2-(chloromethyl)-5-methyl-1,3,4-thiadiazole

InChI: InChI=1S/C4H5ClN2S/c1-3-6-7-4(2-5)8-3/h2H2,1H3

Composition: C (32.33%), H (3.39%), Cl (23.85%), N (18.85%), S (21.57%)

Molar Mass: 148.61

Atom Count: 13

Heavy Atom Count: 8

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	147.986197
Formal Charge	0
FSP3	0.5
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	KMLZHRLGMVZPGX-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	35.02
Topological Polar Surface Area	25.78
Polarizability	12.8
Ring Count	1
Rotatable Bond Count	1

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