DAAO inhibitor-1

CAT: 0127-BUP04147-01Size: 5 mgDry Ice: NoHazardous: No

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CAT#:0127-BUP04147-01Size:5 mg

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24/48H Stock Items & 2 to 6 Weeks non Stock Items.

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CAS Number

2065250-25-9

Purity

=95%

Smiles

OC1=C2C(=NN1)C=C(F)C=C2

Chemical Information

6-fluoro-1H-indazol-3-ol

CAS Number	2065250-25-9
PubChem CID	24728218
IUPAC Name	6-fluoro-1,2-dihydroindazol-3-one
Molecular Formula	C7H5FN2O
Molecular Weight	152.13
XLogP	1.3
Topological Polar Surface Area	41.1
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	0
Heavy Atom Count	11
Formal Charge	0
Complexity	185

SMILES

C1=CC2=C(C=C1F)NNC2=O

InChI

InChI=1S/C7H5FN2O/c8-4-1-2-5-6(3-4)9-10-7(5)11/h1-3H,(H2,9,10,11)

InChIKey

KBPHAHZMJXVUPU-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 2065250-25-9

CID: 24728218

Formula: C7H5FN2O

MW: 152.13

Interactive 3D Structure

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Computed Properties

Property	Value
Molecular Weight	152.13
XLogP3	1.3
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	0
Exact Mass	152.03859095
Monoisotopic Mass	152.03859095
Topological Polar Surface Area	41.1 Å²
Heavy Atom Count	11
Formal Charge	0
Complexity	185
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes