Methyl 6-Fluoroindole-2-carboxylate - CAS 136818-43-4

Catalog:	BB008426
Product Name:	Methyl 6-Fluoroindole-2-carboxylate
CAS:	136818-43-4
Synonyms:	6-fluoro-1H-indole-2-carboxylic acid methyl ester; methyl 6-fluoro-1H-indole-2-carboxylate

Technical Data

Patents

Computed Properties

IUPAC Name:	methyl 6-fluoro-1H-indole-2-carboxylate
Description:	Methyl 6-Fluoroindole-2-carboxylate (CAS# 136818-43-4) is a useful research chemical.
Molecular Weight:	193.17
Molecular Formula:	C10H8FNO2
Canonical SMILES:	COC(=O)C1=CC2=C(N1)C=C(C=C2)F
InChI:	InChI=1S/C10H8FNO2/c1-14-10(13)9-4-6-2-3-7(11)5-8(6)12-9/h2-5,12H,1H3
InChI Key:	JIIBSKHERZAHCH-UHFFFAOYSA-N
Boiling Point:	345.872 °C at 760 mmHg
Density:	1.291 g/cm³
LogP:	2.09360

Publication Number	Title	Priority Date
TW-202106678-A	Novel oxalyl piperazines active against the hepatitis b virus (hbv)	20190430
TW-202106686-A	Novel indolizine-2-carboxamides active against the hepatitis b virus (hbv)	20190430
WO-2020173935-A1	New isoindolinone substituted indoles and derivatives as ras inhibitors	20190226
CN-113474340-A	Novel isoindolinone substituted indoles and derivatives as RAS inhibitors	20190226
EP-3483162-A1	N-alkylsulfonyl-fused heterocyclic compound or salt thereof, pesticide containing said compound, and method for using said pesticide	20160701

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Related Functional Groups

Carbonyl Compounds

[51493-02-8]
N-Methyl-N-propylcarbamoyl Chloride
[87-88-7]
Chloranilic acid
[959574-98-2]
(3-Phenyl-1H-pyrazol-1-yl)acetic acid
[70199-62-1]
(4-Pyridyl)acetone Hydrochloride
[956439-56-8]
1-(Carboxymethyl)-3-nitro-1H-pyrazole-5-carboxylic acid
[253429-30-0]
1-Bromo-2-(2,2-diethoxyethoxy)-4-fluorobenzene

Complexity:	234
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	193.05390666
Formal Charge:	0
Heavy Atom Count:	14
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	193.05390666
Rotatable Bond Count:	2
Topological Polar Surface Area:	42.1
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.6