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Home > Quinoline > 1160253-55-3
1160253-55-3 | 2-(4-Isopropylphenyl)-6-methylquinoline-4-carbonyl chloride
CAS No: 1160253-55-3 Catalog No: AG00HDCM MDL No:MFCD03421147
Product Description
Catalog Number:
AG00HDCM
Chemical Name:
2-(4-Isopropylphenyl)-6-methylquinoline-4-carbonyl chloride
CAS Number:
1160253-55-3
Molecular Formula:
C20H18ClNO
Molecular Weight:
323.8160
MDL Number:
MFCD03421147
IUPAC Name:
6-methyl-2-(4-propan-2-ylphenyl)quinoline-4-carbonyl chloride
InChI:
InChI=1S/C20H18ClNO/c1-12(2)14-5-7-15(8-6-14)19-11-17(20(21)23)16-10-13(3)4-9-18(16)22-19/h4-12H,1-3H3
InChI Key:
LWAVXKUOXIXFRJ-UHFFFAOYSA-N
SMILES:
Cc1ccc2c(c1)c(cc(n2)c1ccc(cc1)C(C)C)C(=O)Cl
Properties
Complexity:
416
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
323.108g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
323.82g/mol
Monoisotopic Mass:
323.108g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
30A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.9
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