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10129-56-3,MFCD00177920
Catalog No.:AA000435
10129-56-3 | 4-Pyridineethanol, α-(trichloromethyl)-
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  • Technical Information
  • Properties
  • Literature
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  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA000435
Chemical Name:
4-Pyridineethanol, α-(trichloromethyl)-
CAS Number:
10129-56-3
Molecular Formula:
C8H8Cl3NO
Molecular Weight:
240.5142
MDL Number:
MFCD00177920
IUPAC Name:
1,1,1-trichloro-3-pyridin-4-ylpropan-2-ol
InChI:
InChI=1S/C8H8Cl3NO/c9-8(10,11)7(13)5-6-1-3-12-4-2-6/h1-4,7,13H,5H2
InChI Key:
NGTDJJKTGRNNAU-UHFFFAOYSA-N
SMILES:
OC(C(Cl)(Cl)Cl)Cc1ccncc1
NSC Number:
13699
Properties
Computed Properties
 
Complexity:
154  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
238.967g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
240.508g/mol
Monoisotopic Mass:
238.967g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
33.1A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  

Synonyms
 
alpha-(trichloromethyl)-4-pyridineethanol 
PETCM cpd 
1-(trichloromethyl)-2-(4-pyridine)ethanol 
Cambridge id 5156091 
GTPL5242 
SCHEMBL4017513 
CHEBI:91963 
CTK7J6109 
DTXSID00279678 
HMS3268C16 
HMS3676F10 
CCG-2272 
PETCM 
ZX-AT024139 
HSCI1_000204 
NSC-13699 
AKOS000525447 
FCH1316978 
MCULE-8064133051 
VP14885 
SMP2_000143 
BAS 00159152 
4-Pyridineethanol, alpha-(trichloromethyl)- 
10129-56-3 
FT-0636635 
1,1,1-trichloro-3-(4-pyridyl)propan-2-ol 
1,1,1-trichloro-3-pyridin-4-ylpropan-2-ol 
1,1,1-Trichloro-3-pyridin-4-yl-propan-2-ol 
SR-01000597497 
J-000358 
SR-01000597497-1 
BRD-A93477898-001-01-8 
BRD-A93477898-001-02-6 
BRD-A93477898-001-03-4 
1,1,1-trichloro-3-(pyridin-4-yl)propan-2-ol 
Z56764761 
D0T5GV 
|A-(trichloromethyl)-4-pyridineethanol 
AR-1L8493 
CID224859 
?-(Trichloromethyl)-4-pyridineethanol 
A4420 
1093-96-5 
alpha-(Trichloromethyl)-4-pyridineethanol 
Apoptosis Activator I 
NSC13699 
AC1L5DLX 
AC1Q3GQB 
Literature

Title: Defects of the apoptotic pathway as therapeutic target against cancer.

Journal: Drug resistance updates : reviews and commentaries in antimicrobial and anticancer chemotherapy 20051201

Title: Apoptosis. Life and death decisions.

Journal: Science (New York, N.Y.) 20030110

Title: Distinctive roles of PHAP proteins and prothymosin-alpha in a death regulatory pathway.

Journal: Science (New York, N.Y.) 20030110

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