Home Carboxes 101494-95-5
101494-95-5,MFCD09954861
Catalog No.:AA0004JF
101494-95-5 | 8-Chloroquinazolin-4(3h)-one
Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
98%
in stock  
$114.00   $80.00
- +
5g
98%
in stock  
$381.00   $267.00
- +
25g
98%
in stock  
$1,143.00   $800.00
- +
  • Technical Information
  • Properties
  • Literature
  • Request for Quotation
  • Q & A
  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA0004JF
Chemical Name:
8-Chloroquinazolin-4(3h)-one
CAS Number:
101494-95-5
Molecular Formula:
C8H5ClN2O
Molecular Weight:
180.5911
MDL Number:
MFCD09954861
IUPAC Name:
8-chloro-3H-quinazolin-4-one
InChI:
InChI=1S/C8H5ClN2O/c9-6-3-1-2-5-7(6)10-4-11-8(5)12/h1-4H,(H,10,11,12)
InChI Key:
JWLJDRWZFALRKE-UHFFFAOYSA-N
SMILES:
Clc1cccc2c1nc[nH]c2=O
Properties
Computed Properties
 
Complexity:
229  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
180.009g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
180.591g/mol
Monoisotopic Mass:
180.009g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
41.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  

Synonyms
 
8-CHLOROQUINAZOLIN-4-OL 
101494-95-5 
SCHEMBL8974755 
CTK8C3815 
CTK8G4345 
DTXSID30445662 
JWLJDRWZFALRKE-UHFFFAOYSA-N 
ANW-70578 
BDBM50365147 
MFCD09954861 
ZINC26894419 
AKOS006337101 
8-CHLOROQUINAZOLIN-4(3H)-ONE 
MB08808 
NE43075 
AJ-82829 
AK-46801 
BS-11829 
AB1010316 
TC-159323 
ST24024570 
Z1901070897 
8-Chloro-4(3H)-quinazolinone 
8-chloro-3,4-dihydroquinazolin-4-one 
ACN-038509 
CID10845104 
N/A 
8-CHLOROQUINAZOLIN-4(1H)-ONE 
CHEMBL1949855 
4(3H)-Quinazolinone, 8-chloro- 
8-chloro-1H-quinazolin-4-one 
Kinome_3256 
SCHEMBL2447579 
Literature
Quotation Request
Company Name:
*
Contact Person:
*
Email:
*
Quantity Required:
*
Additional Info:
Q & A