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202979-35-9 | Quinoline, 4-chloro-2,6,8-trimethyl-5-nitro-
CAS No: 202979-35-9 Catalog No: AG0028LY MDL No:
Product Description
Catalog Number:
AG0028LY
Chemical Name:
Quinoline, 4-chloro-2,6,8-trimethyl-5-nitro-
CAS Number:
202979-35-9
Molecular Formula:
C12H11ClN2O2
Molecular Weight:
250.6809
IUPAC Name:
4-chloro-2,6,8-trimethyl-5-nitroquinoline
InChI:
InChI=1S/C12H11ClN2O2/c1-6-4-7(2)12(15(16)17)10-9(13)5-8(3)14-11(6)10/h4-5H,1-3H3
InChI Key:
YGOUQPUHQCZWIX-UHFFFAOYSA-N
SMILES:
Cc1cc(Cl)c2c(n1)c(C)cc(c2[N+](=O)[O-])C
Properties
Complexity:
307
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
250.051g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
250.682g/mol
Monoisotopic Mass:
250.051g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
58.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8
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