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1443349-42-5 | 3,5-Dichlorophenyl-(1-methyl-2-pyrrolyl)methanol
CAS No: 1443349-42-5 Catalog No: AG01F9LR MDL No:
Product Description
Catalog Number:
AG01F9LR
Chemical Name:
3,5-Dichlorophenyl-(1-methyl-2-pyrrolyl)methanol
CAS Number:
1443349-42-5
Molecular Formula:
C12H11Cl2NO
Molecular Weight:
256.1278
IUPAC Name:
(3,5-dichlorophenyl)-(1-methylpyrrol-2-yl)methanol
InChI:
InChI=1S/C12H11Cl2NO/c1-15-4-2-3-11(15)12(16)8-5-9(13)7-10(14)6-8/h2-7,12,16H,1H3
InChI Key:
WWOCLUPNONGJDW-UHFFFAOYSA-N
SMILES:
Clc1cc(cc(c1)Cl)C(c1cccn1C)O
Properties
Complexity:
229
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
255.022g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
256.126g/mol
Monoisotopic Mass:
255.022g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
25.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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