Home Amines 14085-42-8
14085-42-8,MFCD05263730
Catalog No.:AA001CU6
14085-42-8 | 1H-Pyrazole-1-ethanol, 5-amino-3-phenyl-
Pack Size
Purity
Availability
Price(USD)
Quantity
  
100mg
95.0%
2 weeks  
$178.00
- +
250mg
95.0%
2 weeks  
$240.00
- +
500mg
95%
2 weeks  
$337.00
- +
1g
95%
2 weeks  
$458.00
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  • Technical Information
  • Properties
  • Literature
  • Request for Quotation
  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA001CU6
Chemical Name:
1H-Pyrazole-1-ethanol, 5-amino-3-phenyl-
CAS Number:
14085-42-8
Molecular Formula:
C11H13N3O
Molecular Weight:
203.2404
MDL Number:
MFCD05263730
IUPAC Name:
2-(5-amino-3-phenylpyrazol-1-yl)ethanol
InChI:
InChI=1S/C11H13N3O/c12-11-8-10(13-14(11)6-7-15)9-4-2-1-3-5-9/h1-5,8,15H,6-7,12H2
InChI Key:
VWHSJZHUWWEFAC-UHFFFAOYSA-N
SMILES:
OCCn1nc(cc1N)c1ccccc1
Properties
Computed Properties
 
Complexity:
194  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
203.106g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
203.245g/mol
Monoisotopic Mass:
203.106g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
64.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8  

Synonyms
 
14085-42-8 
2-(5-amino-3-phenyl-1H-pyrazol-1-yl)ethanol 
CTK4C2362 
DTXSID10366629 
VWHSJZHUWWEFAC-UHFFFAOYSA-N 
HMS1754H04 
ZINC2655778 
6838AA 
ANW-53057 
MFCD05263730 
SBB078122 
AKOS005137438 
2-(5-amino-3-phenyl-1H-pyrazol-1-yl)ethan-1-ol 
AS-9572 
MCULE-4107446122 
NE20879 
AJ-44114 
2-(5-amino-3-phenylpyrazolyl)ethan-1-ol 
ST2416134 
TC-141802 
EN300-09077 
SR-01000050564 
SR-01000050564-1 
2-(5-amino-3-phenylpyrazol-1-yl)ethanol 
Z55992976 
F8880-6928 
2-(5-Amino-3-phenyl-1H-pyrazol-1-yl)ethanol, AldrichCPR 
C11H13N3O 
ZINC02655778 
CID2119463 
1H-Pyrazole-1-ethanol,5-amino-3-phenyl- 
1H-Pyrazole-1-ethanol, 5-amino-3-phenyl- 
2-(5-Amino-3-phenyl-pyrazol-1-yl)-ethanol 
AC1M2LNX 
AC1Q51JD 
SCHEMBL891383 
Literature

Title: Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis.

Journal: Bioorganic & medicinal chemistry letters 20101101

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