Home Halogens Benzenemethanol, α-(trichloromethyl)-

Benzenemethanol, α-(trichloromethyl)-

CAS No.:
2000-43-3
Catalog Number:
AG002CI6
Molecular Formula:
C8H7Cl3O
Molecular Weight:
225.4996
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Product Description
Catalog Number:
AG002CI6
Chemical Name:
Benzenemethanol, α-(trichloromethyl)-
CAS Number:
2000-43-3
Molecular Formula:
C8H7Cl3O
Molecular Weight:
225.4996
MDL Number:
MFCD00043571
IUPAC Name:
2,2,2-trichloro-1-phenylethanol
InChI:
InChI=1S/C8H7Cl3O/c9-8(10,11)7(12)6-4-2-1-3-5-6/h1-5,7,12H
InChI Key:
ABFRBTDJEKZSRM-UHFFFAOYSA-N
SMILES:
OC(C(Cl)(Cl)Cl)c1ccccc1
EC Number:
217-887-7
NSC Number:
2796
Properties
Complexity:
138  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
223.956g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
225.493g/mol
Monoisotopic Mass:
223.956g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  
Properties