Ethyl indoline-6-carboxylate - CAS 350683-40-8

Catalog:	BB044342
Product Name:	Ethyl indoline-6-carboxylate
CAS:	350683-40-8
Synonyms:	6-Indolinecarboxylic acid ethyl ester; 2,3-dihydro-1h-indole-6-carboxylic acid ethyl ester

Technical Data

Computed Properties

IUPAC Name:	ethyl 2,3-dihydro-1H-indole-6-carboxylate
Description:	Ethyl indoline-6-carboxylate (CAS# 350683-40-8 ) is a useful research chemical.
Molecular Weight:	191.23
Molecular Formula:	C11H13NO2
Canonical SMILES:	CCOC(=O)C1=CC2=C(CCN2)C=C1
InChI:	InChI=1S/C11H13NO2/c1-2-14-11(13)9-4-3-8-5-6-12-10(8)7-9/h3-4,7,12H,2,5-6H2,1H3
InChI Key:	WFXBELNNLRIRRD-UHFFFAOYSA-N
Boiling Point:	328.2±31.0 °C at 760 mmHg
Purity:	≥ 95 %
Density:	1.1±0.1 g/cm³

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Related Functional Groups

Carbonyl Compounds

[51493-02-8]
N-Methyl-N-propylcarbamoyl Chloride
[1383427-98-2]
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[17746-05-3]
Undecanoyl chloride
[1035840-45-9]
1-(5-Methoxy-1,3-benzoxazol-2-yl)piperidine-3-carboxylic acid
[832741-29-4]
1-(4-Bromo-5-propylthiophen-2-yl)ethanone
[1431966-64-1]
1-{2-[(3-Methoxypropyl)amino]-4-methyl-1,3-thiazol-5-yl}ethanone hydrochloride

Indolines

[2759-12-8]
Indolin-7-amine
[341988-36-1]
Methyl indoline-6-carboxylate
[1187928-05-7]
Methyl indoline-6-carboxylate hydrochloride
[1427475-17-9]
N-(3-Indolinylmethyl)benzylamine
[885272-46-8]
N-Boc-4-bromoindoline
[261732-38-1]
N-Boc-5-bromoindoline

Complexity:	217
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	191.094628657
Formal Charge:	0
Heavy Atom Count:	14
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	191.094628657
Rotatable Bond Count:	3
Topological Polar Surface Area:	38.3
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.3