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80018-10-6 | Phenol,4-chloro-2-[(2-chlorophenyl)(hexylimino)methyl]-
CAS No: 80018-10-6 Catalog No: AG005DRX MDL No:
Product Description
Catalog Number:
AG005DRX
Chemical Name:
Phenol,4-chloro-2-[(2-chlorophenyl)(hexylimino)methyl]-
CAS Number:
80018-10-6
Molecular Formula:
C19H21Cl2NO
Molecular Weight:
350.2821
IUPAC Name:
4-chloro-2-[C-(2-chlorophenyl)-N-hexylcarbonimidoyl]phenol
InChI:
InChI=1S/C19H21Cl2NO/c1-2-3-4-7-12-22-19(15-8-5-6-9-17(15)21)16-13-14(20)10-11-18(16)23/h5-6,8-11,13,23H,2-4,7,12H2,1H3
InChI Key:
MXQCDPGEIVEAGU-UHFFFAOYSA-N
SMILES:
CCCCCCN=C(c1ccccc1Cl)c1cc(Cl)ccc1O
Properties
Complexity:
374
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
349.1g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
350.283g/mol
Monoisotopic Mass:
349.1g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
32.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.6
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