CAS 1475-13-4 | Benzenemethanol, 2,4-dichloro-α-methyl- | CAS Number 1475-13-4

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1475-13-4 | Benzenemethanol, 2,4-dichloro-α-methyl-

CAS No: 1475-13-4 Catalog No: AG001EY3 MDL No:MFCD00004511

Product Description

Catalog Number:

AG001EY3

Chemical Name:

Benzenemethanol, 2,4-dichloro-α-methyl-

CAS Number:

1475-13-4

Molecular Formula:

C8H8Cl2O

Molecular Weight:

191.0545

MDL Number:

MFCD00004511

IUPAC Name:

1-(2,4-dichlorophenyl)ethanol

InChI:

InChI=1S/C8H8Cl2O/c1-5(11)7-3-2-6(9)4-8(7)10/h2-5,11H,1H3

InChI Key:

KWZDYNBHZMQRLS-UHFFFAOYSA-N

SMILES:

Clc1ccc(c(c1)Cl)C(O)C

EC Number:

216-019-4

Properties

Complexity:

129

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

189.995g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

191.051g/mol

Monoisotopic Mass:

189.995g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

20.2A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.7

Literature

Title	Journal
2,4-Dichloro-1-[1-(2,4-dichloro-benz-yl-oxy)eth-yl]benzene.	Acta crystallographica. Section E, Structure reports online 20100101
[Synthesis of a new cyclodextrin derivative and its application as CGC chiral stationary phase in determination of enantiomeric excess].	Se pu = Chinese journal of chromatography 20020101