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146882-07-7 | Benzenepropanol, 2,4-dichloro-
CAS No: 146882-07-7 Catalog No: AG001EEG MDL No:
Product Description
Catalog Number:
AG001EEG
Chemical Name:
Benzenepropanol, 2,4-dichloro-
CAS Number:
146882-07-7
Molecular Formula:
C9H10Cl2O
Molecular Weight:
205.0811
IUPAC Name:
3-(2,4-dichlorophenyl)propan-1-ol
InChI:
InChI=1S/C9H10Cl2O/c10-8-4-3-7(2-1-5-12)9(11)6-8/h3-4,6,12H,1-2,5H2
InChI Key:
NUNJMARRFKAAIM-UHFFFAOYSA-N
SMILES:
OCCCc1ccc(cc1Cl)Cl
Properties
Complexity:
130
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
204.011g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
205.078g/mol
Monoisotopic Mass:
204.011g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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