AG00C28G

3122-84-7 | 4-Chloro-6-(methoxymethyl)pyrimidine

AG00C28G

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CAS Number	3122-84-7
Catalog Number	AG00C28G(AGN-PC-0010BJ)
Chemical Name	4-Chloro-6-(methoxymethyl)pyrimidine
IUPAC Name	4-chloro-6-(methoxymethyl)pyrimidine
InChI	InChI=1S/C6H7ClN2O/c1-10-3-5-2-6(7)9-4-8-5/h2,4H,3H2,1H3
InChI Key	QOOQUMTZWQEHTR-UHFFFAOYSA-N
MDL Number	MFCD16707817
Molecular Formula	C6H7ClN2O
Molecular Weight	158.5856
SMILES	COCC1=CC(Cl)=NC=N1
Synonyms	4-chloro-6-(methoxymethyl)pyrimidine, 3122-84-7, 4-Chloro-6-(methoxymethyl)-pyrimidine, SCHEMBL274345, DTXSID20558750, QOOQUMTZWQEHTR-UHFFFAOYSA-N, 6-chloro-4-methoxymethylpyrimidine, MFCD16707817, ZINC34267504, AKOS011603863, RP22227, AJ-87729, AS-43636, Pyrimidine, 4-chloro-6-(methoxymethyl)-, SC-66193, CS-0045696, 4-chloro-6-(methoxymethyl)pyrimidine(SALTDATA, Y-7723, F8880-0861, Z1982490417,

Complexity	102
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	158.025g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	158.585g/mol
Monoisotopic Mass	158.025g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	35A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.9

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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