AG007DEI

17180-94-8 | 5-Chloropyrimidine

AG007DEI

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CAS Number	17180-94-8
Catalog Number	AG007DEI(AGN-PC-0NJK6Y)
Chemical Name	5-Chloropyrimidine
IUPAC Name	5-chloropyrimidine
InChI	InChI=1S/C4H3ClN2/c5-4-1-6-3-7-2-4/h1-3H
InChI Key	ZLNPDTOTEVIMMY-UHFFFAOYSA-N
MDL Number	MFCD03840717
Molecular Formula	C4H3ClN2
Molecular Weight	114.5330
SMILES	ClC1=CN=CN=C1
Synonyms	5-Chloropyrimidine, 17180-94-8, pyrimidine, 5-chloro-, 5-Chloro-pyrimidine, 5-Chloropyrimidine, 95%, 5-choloropyrimidine, 5-chloranylpyrimidine, PubChem7041, SCHEMBL198750, CTK0H4410, ZLNPDTOTEVIMMY-UHFFFAOYSA-N, ACT01272, KS-00000JL6, ZINC2513831, ANW-50862, BBL103126, MFCD03840717, STL556936, AKOS006282497, AB16528, AM86690, CC-1347, CS-W005718, GS-6489, LS20622, QC-9237, RP19170, VP50287, AC-26672, AJ-36887, AK-26627, BR-26627, CJ-08704, HC210163, SC-01672, AB0005425, DB-007030, ST2411979, TC-061208, 4CH-003902, FT-0080638, FT-0600949, X3259, S-5262, 180C948, A811354, Q-102308, Thionitrosyl chloride, C4H3ClN2, Pyrimidine, 5-chloro- (6CI,8CI,9CI),

Complexity	51.7
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	113.998g/mol
Formal Charge	0
Heavy Atom Count	7
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	114.532g/mol
Monoisotopic Mass	113.998g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	25.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.5

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

Lot Number