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Compound Fr14290

CAT: 0931-Fr14290-01Size: 1 gDry Ice: NoHazardous: No
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CAT#:0931-Fr14290-01Size:1 g
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CAS Number
1076-74-0
Purity
0.9799
Bioactivity
Compound Fr14290, with CAS No. 1076-74-0, is a fragment molecule that serves as an important scaffold for molecular linking, expansion, and modification. Compound Fr14290 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
COc1ccc2[nH]c(C)cc2c1
Molecular Formula
C10H11NO
Molecular Weight
161.2
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

5-Methoxy-2-methylindole

5-Methoxy-2-methyl-1H-indole is a member of indoles.

CAS Number1076-74-0
PubChem CID70642
IUPAC Name5-methoxy-2-methyl-1H-indole
Molecular FormulaC10H11NO
Molecular Weight161.20
XLogP2
Topological Polar Surface Area25
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count1
Heavy Atom Count12
Formal Charge0
Complexity160
SMILES
CC1=CC2=C(N1)C=CC(=C2)OC
InChI
InChI=1S/C10H11NO/c1-7-5-8-6-9(12-2)3-4-10(8)11-7/h3-6,11H,1-2H3
InChIKey
VSWGLJOQFUMFOQ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 5-Methoxy-2-methylindole
CAS: 1076-74-0
CID: 70642
Formula: C10H11NO
MW: 161.20
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight161.20
XLogP32
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count1
Exact Mass161.084063974
Monoisotopic Mass161.084063974
Topological Polar Surface Area25 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
Fr14390-01Compound Fr14390
Fr14250-01Compound Fr14250
Fr14200-01Compound Fr14200
Fr14294-01Compound Fr14294
Fr14291-01Compound Fr14291
Fr14240-01Compound Fr14240
Fr14296-01Compound Fr14296
Fr14292-01Compound Fr14292
Fr14230-01Compound Fr14230

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HY-14176-01Compound E
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2573-5Compound 112254
MBS3613444-01Compound W
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