AG0037IN

37972-24-0 | 2-ETHYNYLPYRIMIDINE

AG0037IN

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CAS Number	37972-24-0
Catalog Number	AG0037IN(AGN-PC-0NIZ59)
Chemical Name	2-ETHYNYLPYRIMIDINE
IUPAC Name	2-ethynylpyrimidine
InChI	InChI=1S/C6H4N2/c1-2-6-7-4-3-5-8-6/h1,3-5H
InChI Key	BMNUHRHTDNKJII-UHFFFAOYSA-N
MDL Number	MFCD10698134
Molecular Formula	C6H4N2
Molecular Weight	104.1094
SMILES	C(#C)C1=NC=CC=N1
Synonyms	2-ETHYNYLPYRIMIDINE, 37972-24-0, Pyrimidine, 2-ethynyl-, AK-34927, PYRIMIDINE, 2-ETHYNYL- (9CI), 2-Ethynylpyrimidine, 97%, SCHEMBL1324980, 2-Ethynylpyrimidine, AldrichCPR, CTK1C1320, KS-00000HPX, DTXSID50498377, BMNUHRHTDNKJII-UHFFFAOYSA-N, ANW-51697, FCH882164, MFCD10698134, ZINC39053289, AKOS006302959, AB61370, CS-W019045, RP18832, AJ-97630, BR-34927, CJ-19672, DS-12315, SC-91328, AB0024578, AX8160291, TR-015366, 4CH-008547, ST24027987, W5876, S-6910, J-509348, Methyl 3-butynoate, C6H4N2, 32804-66-3,

Complexity	105
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	104.037g/mol
Formal Charge	0
Heavy Atom Count	8
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	104.112g/mol
Monoisotopic Mass	104.037g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	25.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	-0.2

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H319
Packing Group
Precautionary statements	P305+P351+P338
UN Code

Certificate of Analysis

Lot Number