AG007M7S

25742-12-5 | Thiazole-5-carbonitrile

AG007M7S

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CAS Number	25742-12-5
Catalog Number	AG007M7S(AGN-PC-03DAM2)
Chemical Name	Thiazole-5-carbonitrile
IUPAC Name	1,3-thiazole-5-carbonitrile
InChI	InChI=1S/C4H2N2S/c5-1-4-2-6-3-7-4/h2-3H
InChI Key	XWXPRCDFFCVMNT-UHFFFAOYSA-N
MDL Number	MFCD06797206
Molecular Formula	C4H2N2S
Molecular Weight	110.1371
SMILES	S1C(=CN=C1)C#N
Synonyms	thiazole-5-carbonitrile, 25742-12-5, 5-CYANOTHIAZOLE, 1,3-thiazole-5-carbonitrile, 5-Thiazolecarbonitrile, 5-cyanothiazole, AldrichCPR, SCHEMBL448862, CTK0J9588, DTXSID40616407, XWXPRCDFFCVMNT-UHFFFAOYSA-N, ALBB-026989, KS-000024KB, ANW-50031, MFCD06797206, ZINC35322848, AKOS006282133, CS-W006024, DS-0444, MCULE-5960696338, QC-6461, RP18985, AJ-91255, AK-25194, BR-25194, CJ-18730, AB0023775, DB-000648, ST2413980, TR-011698, 4CH-008414, FT-0649730, W4910, S-7444, 742C125, J-517442, I14-11440, Z1354602497, C4H2N2S,

Complexity	104
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	109.994g/mol
Formal Charge	0
Heavy Atom Count	7
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	110.134g/mol
Monoisotopic Mass	109.994g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	64.9A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H332-H335
Packing Group
Precautionary statements	P261-P280-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number