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Hydralazine Hydroxy Impurity

CAT: 1299-RM-H041202-02Size: 25 mgDry Ice: NoHazardous: No
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CAT#:1299-RM-H041202-02Size:25 mg
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CAS Number
119-39-1
Synonyms
Phthalazin-1-ol
Molecular Formula
C8H6N2O
Molecular Weight
146.15
Target Alternative Name
Hydralazine
Product Name Synonym
Phthalazin-1-ol

Chemical Information

1(2H)-Phthalazinone

Phthalazin-1(2H)-one is a member of phthalazines.

CAS Number119-39-1
PubChem CID8394
IUPAC Name2H-phthalazin-1-one
Molecular FormulaC8H6N2O
Molecular Weight146.15
XLogP0.8
Topological Polar Surface Area41.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count0
Heavy Atom Count11
Formal Charge0
Complexity200
SMILES
C1=CC=C2C(=C1)C=NNC2=O
InChI
InChI=1S/C8H6N2O/c11-8-7-4-2-1-3-6(7)5-9-10-8/h1-5H,(H,10,11)
InChIKey
IJAPPYDYQCXOEF-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 1(2H)-Phthalazinone
CAS: 119-39-1
CID: 8394
Formula: C8H6N2O
MW: 146.15
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight146.15
XLogP30.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count0
Exact Mass146.048012819
Monoisotopic Mass146.048012819
Topological Polar Surface Area41.5 Ų
Heavy Atom Count11
Formal Charge0
Complexity200
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes