AG003H88

46815-10-5 | 2-(Ethylthio)-10H-phenothiazine

AG003H88

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CAS Number	46815-10-5
Catalog Number	AG003H88(AGN-PC-0JTXMP)
Chemical Name	2-(Ethylthio)-10H-phenothiazine
IUPAC Name	2-ethylsulfanyl-10H-phenothiazine
InChI	InChI=1S/C14H13NS2/c1-2-16-10-7-8-14-12(9-10)15-11-5-3-4-6-13(11)17-14/h3-9,15H,2H2,1H3
InChI Key	DMHPUUIDINBWBN-UHFFFAOYSA-N
MDL Number	MFCD00191362
Molecular Formula	C14H13NS2
Molecular Weight	259.3897
SMILES	CCSc1ccc2Sc3ccccc3Nc2c1
Synonyms	2-Ethylthiophenothiazine, 46815-10-5, 2-(Ethylthio)-10H-phenothiazine, 10H-Phenothiazine, 2-(ethylthio)-, 2-(Ethylthio)phenothiazine, C14H13NS2, AC1LDM5S, ACMC-209k7r, SCHEMBL3690883, DTXSID6068484, CTK1D6971, DMHPUUIDINBWBN-UHFFFAOYSA-N, 2-ethylsulfanyl-10H-phenothiazine, ZINC2556791, ANW-30469, MFCD00191362, AKOS027327411, 2-(Ethylsulfanyl)-10H-phenothiazine #, ACM46815105, TC-119214, E0447, V1726, KS-00001527, I14-61777, C14-H13-N-S2, CID621186,

Complexity	259
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	259.049g/mol
Formal Charge	0
Heavy Atom Count	17
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	259.385g/mol
Monoisotopic Mass	259.049g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	62.6A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	5

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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