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79899-09-5 | Imidazo[1,5-a]pyrimidine, 2-chloro-4-methyl-6-(1-methylethyl)-
CAS No: 79899-09-5 Catalog No: AG005F6Z MDL No:
Product Description
Catalog Number:
AG005F6Z
Chemical Name:
Imidazo[1,5-a]pyrimidine, 2-chloro-4-methyl-6-(1-methylethyl)-
CAS Number:
79899-09-5
Molecular Formula:
C10H12ClN3
Molecular Weight:
209.6754
IUPAC Name:
2-chloro-4-methyl-6-propan-2-ylimidazo[1,5-a]pyrimidine
InChI:
InChI=1S/C10H12ClN3/c1-6(2)10-12-5-9-13-8(11)4-7(3)14(9)10/h4-6H,1-3H3
InChI Key:
APQIPGPKTZWPEZ-UHFFFAOYSA-N
SMILES:
Clc1cc(C)n2c(n1)cnc2C(C)C
Properties
Complexity:
210
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
209.072g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
209.677g/mol
Monoisotopic Mass:
209.072g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
30.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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