AG008S3E

1119280-68-0 | 2-Chlorothieno[3,2-d]pyrimidine

AG008S3E

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CAS Number	1119280-68-0
Catalog Number	AG008S3E(AGN-PC-0WA6K1)
Chemical Name	2-Chlorothieno[3,2-d]pyrimidine
IUPAC Name	2-chlorothieno[3,2-d]pyrimidine
InChI	InChI=1S/C6H3ClN2S/c7-6-8-3-5-4(9-6)1-2-10-5/h1-3H
InChI Key	QKRVOGZPQVCVPZ-UHFFFAOYSA-N
MDL Number	MFCD12406127
Molecular Formula	C6H3ClN2S
Molecular Weight	170.6194
SMILES	ClC1=NC2=C(C=N1)SC=C2
Synonyms	2-chlorothieno[3,2-d]pyrimidine, 1119280-68-0, chlorothienopyrimidine, 2-Chloro-thieno[3,2-d]pyrimidine, SCHEMBL358864, CHEMBL3236405, CTK4A7577, DTXSID60670662, QKRVOGZPQVCVPZ-UHFFFAOYSA-N, ACT07328, BCP14947, KS-00000IB2, 2-chlorothiopheno[3,2-d]pyrimidine, ANW-49475, MFCD12406127, QC-739, SBB088458, ZINC43828344, AKOS005073854, CS-W006642, HP23610, PB17979, RP23313, AK-28171, BR-28171, SC-44767, AB0004718, AJ-109052, DB-014094, ST2409947, TR-034065, 4CH-009141, AM20080068, FT-0681731, X3287, S-6422, J-509180, C6H3ClN2S,

Complexity	133
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	169.971g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	170.614g/mol
Monoisotopic Mass	169.971g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	54A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.3

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

Lot Number