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Compound Fr14097

CAT: 0931-Fr14097-02Size: 200 mgDry Ice: NoHazardous: No
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CAT#:0931-Fr14097-02Size:200 mg
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CAS Number
13466-41-6
Bioactivity
Compound Fr14097, with CAS No. 13466-41-6, is a fragment molecule that serves as an important scaffold for molecular linking, expansion, and modification. Compound Fr14097 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
Cc1ccnc(O)c1
Molecular Formula
C6H7NO
Molecular Weight
109.128
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

2-Hydroxy-4-methylpyridine

2-Hydroxy-4-methylpyridine is a member of methylpyridines.

CAS Number13466-41-6
PubChem CID280741
IUPAC Name4-methyl-1H-pyridin-2-one
Molecular FormulaC6H7NO
Molecular Weight109.13
XLogP0.1
Topological Polar Surface Area29.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count0
Heavy Atom Count8
Formal Charge0
Complexity167
SMILES
CC1=CC(=O)NC=C1
InChI
InChI=1S/C6H7NO/c1-5-2-3-7-6(8)4-5/h2-4H,1H3,(H,7,8)
InChIKey
YBDRFJXGJQULGH-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-Hydroxy-4-methylpyridine
CAS: 13466-41-6
CID: 280741
Formula: C6H7NO
MW: 109.13
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight109.13
XLogP30.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count0
Exact Mass109.052763847
Monoisotopic Mass109.052763847
Topological Polar Surface Area29.1 Ų
Heavy Atom Count8
Formal Charge0
Complexity167
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
Fr14090-01Compound Fr14090
Fr14099-01Compound Fr14099
Fr14497-01Compound Fr14497
Fr14094-01Compound Fr14094
Fr14037-01Compound Fr14037
Fr14091-01Compound Fr14091
Fr14397-01Compound Fr14397
Fr14297-01Compound Fr14297
Fr13097-01Compound Fr13097
Fr14017-01Compound Fr14017

Alternative Products

CatalogName
ALX-550-516-M025Compound A
C8444-50Compound C108
C5824-10GPR120 Compound A
A8197-5.1Compound 56
B7337-5Compound 401
XXC35825-01Compound 3a
HY-14176-01Compound E
HY-U00358Compound 2
1898-200Compound 34
2573-5Compound 112254

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