Methyl 1-Methylindole-6-carboxylate - CAS 1204-32-6

Catalog:	BB004866
Product Name:	Methyl 1-Methylindole-6-carboxylate
CAS:	1204-32-6
Synonyms:	1-methyl-6-indolecarboxylic acid methyl ester; methyl 1-methylindole-6-carboxylate

Technical Data

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Computed Properties

IUPAC Name:	methyl 1-methylindole-6-carboxylate
Description:	Methyl 1-Methylindole-6-carboxylate (CAS# 1204-32-6) is a useful research chemical.
Molecular Weight:	189.21
Molecular Formula:	C11H11NO2
Canonical SMILES:	CN1C=CC2=C1C=C(C=C2)C(=O)OC
InChI:	InChI=1S/C11H11NO2/c1-12-6-5-8-3-4-9(7-10(8)12)11(13)14-2/h3-7H,1-2H3
InChI Key:	NMILWYUYIFMKTE-UHFFFAOYSA-N
Boiling Point:	320.2 °C at 760 mmHg
Density:	1.14 g/cm³
MDL:	MFCD06245515
LogP:	1.96490

Publication Number	Title	Priority Date
CN-106117113-B	Polysubstituted carbazole, derivative and its synthetic method	20160702
CN-109328059-B	Selective inhibitors of clinically important mutants of EGFR tyrosine kinase	20160107
CN-104387407-A	6-methyl-6H-benzo[4, 5]thiophene[2, 3-b]indole and derivatives thereof as well as synthesis method of 6-methyl-6H-benzo[4, 5]thiophene[2, 3-b]indole and derivatives thereof	20141128
EP-3204360-A1	Therapeutic compounds and uses thereof	20141010
JP-2017530176-A	Therapeutic compounds and uses thereof	20141010

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Related Functional Groups

Carbonyl Compounds

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[87-88-7]
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[1427004-19-0]
DBCO-PEG4-NHS ester
[1383427-98-2]
(S)-Hexahydropyrazino[2,1-c][1,4]oxazin-4(3H)-one hydrochloride
[70199-62-1]
(4-Pyridyl)acetone Hydrochloride
[1018141-88-2]
1-(2-Cyanoethyl)-3-methyl-6-phenyl-1H-pyrazolo[3,4-b]pyridine-4-carboxylic acid

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GHS Hazard Statement:	H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]; H312 (100%): Harmful in contact with skin [Warning Acute toxicity, dermal]; H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]; H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]; H332 (100%): Harmful if inhaled [Warning Acute toxicity, inhalation]; H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
Precautionary Statement:	P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	229
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	189.078978594
Formal Charge:	0
Heavy Atom Count:	14
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	189.078978594
Rotatable Bond Count:	2
Topological Polar Surface Area:	31.2
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.9