AG000IES

119223-01-7 | 1,2,4-OXADIAZOLE, 5-(CHLOROMETHYL)-3-CYCLOPROPYL-

AG000IES

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CAS Number	119223-01-7
Catalog Number	AG000IES(AGN-PC-0NL6WT)
Chemical Name	1,2,4-OXADIAZOLE, 5-(CHLOROMETHYL)-3-CYCLOPROPYL-
IUPAC Name	5-(chloromethyl)-3-cyclopropyl-1,2,4-oxadiazole
InChI	InChI=1S/C6H7ClN2O/c7-3-5-8-6(9-10-5)4-1-2-4/h4H,1-3H2
InChI Key	YWRZTXKBYCOPMY-UHFFFAOYSA-N
MDL Number	MFCD09816101
Molecular Formula	C6H7ClN2O
Molecular Weight	158.5856
SMILES	ClCc1onc(n1)C1CC1
Synonyms	5-(chloromethyl)-3-cyclopropyl-1,2,4-oxadiazole, 119223-01-7, 1,2,4-OXADIAZOLE, 5-(CHLOROMETHYL)-3-CYCLOPROPYL-, AC1Q3U3Z, SCHEMBL9366491, CTK4B1142, DTXSID90579694, YWRZTXKBYCOPMY-UHFFFAOYSA-N, ALBB-032160, MFCD09816101, ZINC12803975, AKOS000157103, AJ-63036, AS-39400, AB1007504, DB-013941, RT-010124, FT-0707178, EN300-29739, 5-chloromethyl-3-cyclopropyl-1,2,4-oxadiazole, Y-5568, J-004084, I14-12504, F8889-5294, 3-Cyclopropyl-5-chloromethyl-1,2,4-oxadiazole, AldrichCPR, null, ACN-039688,

Complexity	129
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	158.025g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	158.585g/mol
Monoisotopic Mass	158.025g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	38.9A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.1

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	8
Hazard statements	H302-H314
Packing Group	Ⅲ
Precautionary statements	P261-P280-P305+P351+P338-P310
UN Code	UN 3261

Certificate of Analysis

Lot Number