AG00E3P8

53645-94-6 | 2-Chloro-5-methyl-1,3,4-thiadiazole

AG00E3P8

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CAS Number	53645-94-6
Catalog Number	AG00E3P8(AGN-PC-00K91Q)
Chemical Name	2-Chloro-5-methyl-1,3,4-thiadiazole
IUPAC Name	2-chloro-5-methyl-1,3,4-thiadiazole
InChI	InChI=1S/C3H3ClN2S/c1-2-5-6-3(4)7-2/h1H3
InChI Key	IPLGMBJDQYRJLJ-UHFFFAOYSA-N
MDL Number	MFCD17170011
Molecular Formula	C3H3ClN2S
Molecular Weight	134.5873
SMILES	Cc1nnc(s1)Cl
Synonyms	2-chloro-5-methyl-1,3,4-thiadiazole, 53645-94-6, 1,3,4-Thiadiazole, 2-chloro-5-methyl-, AC1Q2PWK, SCHEMBL7047248, CTK1G0512, DTXSID00513903, ALBB-017815, 5148AE, MFCD17170011, STL434066, ZINC39348795, AKOS012692442, MCULE-1360893454, 2-chloro-5-methyl-[1,3,4]thiadiazole, AJ-99961, DB-071726, FT-0743432, EN300-81988, Y-7795, 2-Chloro-5-methyl-1,3,4-thiadiazole, AldrichCPR, I09-1847, F8881-1239, C3H3ClN2S,

Complexity	70
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	133.971g/mol
Formal Charge	0
Heavy Atom Count	7
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	134.581g/mol
Monoisotopic Mass	133.971g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	54A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.7

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302
Packing Group
Precautionary statements	P301+P312+P330
UN Code

Certificate of Analysis

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