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Compound Fr14070

CAT: 0931-Fr14070-03Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0931-Fr14070-03Size:10 mg
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CAS Number
854778-61-3
Bioactivity
Compound Fr14070, with CAS No. 854778-61-3, is a fragment molecule that serves as an important scaffold for molecular linking, expansion, and modification. Compound Fr14070 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
Cn1ccc2cccc(CO)c12
Molecular Formula
C10H11NO
Molecular Weight
161.2
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

(1-methyl-1H-indol-7-yl)methanol
CAS Number854778-61-3
PubChem CID24229741
IUPAC Name(1-methylindol-7-yl)methanol
Molecular FormulaC10H11NO
Molecular Weight161.20
XLogP1.1
Topological Polar Surface Area25.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count1
Heavy Atom Count12
Formal Charge0
Complexity160
SMILES
CN1C=CC2=C1C(=CC=C2)CO
InChI
InChI=1S/C10H11NO/c1-11-6-5-8-3-2-4-9(7-12)10(8)11/h2-6,12H,7H2,1H3
InChIKey
XWTPJITYDAXWKC-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of (1-methyl-1H-indol-7-yl)methanol
CAS: 854778-61-3
CID: 24229741
Formula: C10H11NO
MW: 161.20
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight161.20
XLogP31.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count1
Exact Mass161.084063974
Monoisotopic Mass161.084063974
Topological Polar Surface Area25.2 Ų
Heavy Atom Count12
Formal Charge0
Complexity160
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
Fr14074-01Compound Fr14074
Fr14078-01Compound Fr14078
Fr14072-01Compound Fr14072
Fr14071-01Compound Fr14071
Fr14040-01Compound Fr14040
Fr14030-01Compound Fr14030
Fr14075-01Compound Fr14075
Fr14010-01Compound Fr14010
Fr14079-01Compound Fr14079

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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