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Compound Fr16699

CAT: 0931-Fr16699-02Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0931-Fr16699-02Size:10 mg
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CAS Number
113293-71-3
Purity
0.9989
Bioactivity
Compound Fr16699, with CAS No. 113293-71-3, is a fragment molecule that serves as an important scaffold for molecular linking, expansion, and modification. Compound Fr16699 provides a structural basis and research tool for the design and screening of novel drug candidates, and is commonly used in drug discovery, drug synthesis, and related research.
Smiles
NC1=NC=C(CO)C=C1
Molecular Formula
C6H8N2O
Molecular Weight
124.14
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

(6-Aminopyridin-3-yl)methanol
CAS Number113293-71-3
PubChem CID2794829
IUPAC Name(6-amino-3-pyridinyl)methanol
Molecular FormulaC6H8N2O
Molecular Weight124.14
XLogP-0.2
Topological Polar Surface Area59.1
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count1
Heavy Atom Count9
Formal Charge0
Complexity87
SMILES
C1=CC(=NC=C1CO)N
InChI
InChI=1S/C6H8N2O/c7-6-2-1-5(4-9)3-8-6/h1-3,9H,4H2,(H2,7,8)
InChIKey
TXPRFSOGPYITOT-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of (6-Aminopyridin-3-yl)methanol
CAS: 113293-71-3
CID: 2794829
Formula: C6H8N2O
MW: 124.14
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight124.14
XLogP3-0.2
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count1
Exact Mass124.063662883
Monoisotopic Mass124.063662883
Topological Polar Surface Area59.1 Ų
Heavy Atom Count9
Formal Charge0
Complexity87.1
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

Related Products

CatalogName
Fr16696-01Compound Fr16696
Fr16697-01Compound Fr16697
Fr16639-01Compound Fr16639
Fr16609-01Compound Fr16609
Fr16690-01Compound Fr16690
Fr16698-01Compound Fr16698
Fr16679-01Compound Fr16679
Fr16669-01Compound Fr16669
Fr12699-01Compound Fr12699
Fr16691-01Compound Fr16691

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CatalogName
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C8444-50Compound C108
C5824-10GPR120 Compound A
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B7337-5Compound 401
XXC35825-01Compound 3a
HY-14176-01Compound E
HY-U00358Compound 2
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