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234-30-0 | 1,3-Dioxolo[4,5-h]quinazoline (8CI,9CI)
CAS No: 234-30-0 Catalog No: AG002N46 MDL No:
Product Description
Catalog Number:
AG002N46
Chemical Name:
1,3-Dioxolo[4,5-h]quinazoline (8CI,9CI)
CAS Number:
234-30-0
Molecular Formula:
C9H6N2O2
Molecular Weight:
174.1561
IUPAC Name:
[1,3]dioxolo[4,5-h]quinazoline
InChI:
InChI=1S/C9H6N2O2/c1-2-7-9(13-5-12-7)8-6(1)3-10-4-11-8/h1-4H,5H2
InChI Key:
NYWDTNWEQNOENK-UHFFFAOYSA-N
SMILES:
C1Oc2c(O1)c1ncncc1cc2
Properties
Complexity:
200
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
174.043g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
174.159g/mol
Monoisotopic Mass:
174.043g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
44.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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