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952182-94-4 | 4-cyclopropyl-6H,7H-[1,2]oxazolo[3,4-d]pyridazin-7-one
CAS No: 952182-94-4 Catalog No: AG00IW69 MDL No:MFCD09152706
Product Description
Catalog Number:
AG00IW69
Chemical Name:
4-cyclopropyl-6H,7H-[1,2]oxazolo[3,4-d]pyridazin-7-one
CAS Number:
952182-94-4
Molecular Formula:
C8H7N3O2
Molecular Weight:
177.1601
MDL Number:
MFCD09152706
IUPAC Name:
4-cyclopropyl-6H-[1,2]oxazolo[3,4-d]pyridazin-7-one
InChI:
InChI=1S/C8H7N3O2/c12-8-7-5(3-13-11-7)6(9-10-8)4-1-2-4/h3-4H,1-2H2,(H,10,12)
InChI Key:
MIAHTBIMJZUYTO-UHFFFAOYSA-N
SMILES:
O=c1[nH]nc(c2c1noc2)C1CC1
Properties
Complexity:
285
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
177.054g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
177.163g/mol
Monoisotopic Mass:
177.054g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
67.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3
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