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1015846-31-7,MFCD09971217
Catalog No.:AA0004SZ
1015846-31-7 | 4-Chloro-5-isopropyl-2-methylpyrimidine
Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
95%
in stock  
$223.00   $156.00
- +
5g
95%
in stock  
$731.00   $512.00
- +
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Technical Information
Catalog Number:
AA0004SZ
Chemical Name:
4-Chloro-5-isopropyl-2-methylpyrimidine
CAS Number:
1015846-31-7
Molecular Formula:
C8H11ClN2
Molecular Weight:
170.6393
MDL Number:
MFCD09971217
IUPAC Name:
4-chloro-2-methyl-5-propan-2-ylpyrimidine
InChI:
InChI=1S/C8H11ClN2/c1-5(2)7-4-10-6(3)11-8(7)9/h4-5H,1-3H3
InChI Key:
AYJVOUWHWPMKEB-UHFFFAOYSA-N
SMILES:
Cc1ncc(c(n1)Cl)C(C)C
Properties
Computed Properties
 
Complexity:
127  
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:
2.7  

Synonyms
 
4-CHLORO-5-ISOPROPYL-2-METHYLPYRIMIDINE 
1015846-31-7 
7391AC 
FCH878901 
MFCD09971217 
ZINC19091758 
AKOS005173470 
MCULE-2785720073 
AJ-71683 
AB0157525 
AB1007508 
FT-0683378 
4-Chloro-2-methyl-5-(propan-2-yl)pyrimidine 
Y-6125 
I03-1146 
null 
C8H11ClN2 
pyrimidine, 4-chloro-2-methyl-5-(1-methylethyl)- 
SCHEMBL16369415 
CTK3J9971 
DTXSID90647968 
ALBB-011810 
ZX-AN010627 
ZX-CM005711 
Literature
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