AG00AMCW

18436-67-4 | 4-CHLORO-2-TERTBUTYLPYRIMIDINE

AG00AMCW

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CAS Number	18436-67-4
Catalog Number	AG00AMCW(AGN-PC-04TM5M)
Chemical Name	4-CHLORO-2-TERTBUTYLPYRIMIDINE
IUPAC Name	2-tert-butyl-4-chloropyrimidine
InChI	InChI=1S/C8H11ClN2/c1-8(2,3)7-10-5-4-6(9)11-7/h4-5H,1-3H3
InChI Key	WJXFFDWYYFLYFK-UHFFFAOYSA-N
MDL Number	MFCD10697056
Molecular Formula	C8H11ClN2
Molecular Weight	170.6393
SMILES	CC(C)(C)C1=NC(Cl)=CC=N1
Synonyms	2-tert-Butyl-4-chloropyrimidine, 18436-67-4, 2-(TERT-BUTYL)-4-CHLOROPYRIMIDINE, 4-CHLORO-2-TERTBUTYLPYRIMIDINE, SCHEMBL11113890, CTK8C2896, DTXSID50647969, KS-00000HO1, ANW-69218, MFCD10697056, ZINC36882191, AKOS009845225, AB58883, DS-2530, MP-1948, AJ-93401, AK-37365, CJ-18988, AB0053111, DB-010238, TC-157963, 4CH-008484, CS-0036296, FT-0726053, ST24028143, Z4326, C8H11ClN2,

Complexity	131
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	170.061g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	170.64g/mol
Monoisotopic Mass	170.061g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	25.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.9

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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