Home Halogens 4-chloro-6H,7H,8H-pyrimido[5,4-b][1,4]oxazine

4-chloro-6H,7H,8H-pyrimido[5,4-b][1,4]oxazine

CAS No.:
1309377-79-4
Catalog Number:
AG01A2HY
Molecular Formula:
C6H6ClN3O
Molecular Weight:
171.5843
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG01A2HY
Chemical Name:
4-chloro-6H,7H,8H-pyrimido[5,4-b][1,4]oxazine
CAS Number:
1309377-79-4
Molecular Formula:
C6H6ClN3O
Molecular Weight:
171.5843
MDL Number:
MFCD20688584
IUPAC Name:
4-chloro-7,8-dihydro-6H-pyrimido[5,4-b][1,4]oxazine
InChI:
InChI=1S/C6H6ClN3O/c7-5-4-6(10-3-9-5)8-1-2-11-4/h3H,1-2H2,(H,8,9,10)
InChI Key:
VSRCZDKHYQKDRZ-UHFFFAOYSA-N
SMILES:
Clc1ncnc2c1OCCN2
Properties
Complexity:
146  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
171.02g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
171.584g/mol
Monoisotopic Mass:
171.02g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
47A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  
Properties