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Methyl 1,2,3,4-Tetrahydronaphthalene-1-carboxylate

Methyl 1,2,3,4-Tetrahydronaphthalene-1-carboxylate - CAS 17502-86-2

Catalog:	BB013069
Product Name:	Methyl 1,2,3,4-Tetrahydronaphthalene-1-carboxylate
CAS:	17502-86-2
Synonyms:	1,2,3,4-tetrahydronaphthalene-1-carboxylic acid methyl ester; methyl 1,2,3,4-tetrahydronaphthalene-1-carboxylate

Technical Data

Patents

Computed Properties

IUPAC Name:	methyl 1,2,3,4-tetrahydronaphthalene-1-carboxylate
Description:	Methyl 1,2,3,4-Tetrahydronaphthalene-1-carboxylate (CAS# 17502-86-2) is a useful research chemical.
Molecular Weight:	190.24
Molecular Formula:	C12H14O2
Canonical SMILES:	COC(=O)C1CCCC2=CC=CC=C12
InChI:	InChI=1S/C12H14O2/c1-14-12(13)11-8-4-6-9-5-2-3-7-10(9)11/h2-3,5,7,11H,4,6,8H2,1H3
InChI Key:	GBNNKNLJHYPKIG-UHFFFAOYSA-N
LogP:	2.27950

Publication Number	Title	Priority Date
TW-202010500-A	Pyrazolotriazolopyrimidine derivatives as A2A receptor	20180408
WO-2019196803-A1	Pyrazolotriazolopyrimidine derivatives as a2a receptor antagonist	20180408
AU-2019251148-A1	Pyrazolotriazolopyrimidine derivatives as A2A receptor antagonist	20180408
BR-112020020078-A2	FORMULA COMPOUND, PHARMACEUTICAL COMPOSITION, CANCER TREATMENT METHOD AND FORMULA 5 AND 13 COMPOUNDS	20180408
CN-112313234-A	Pyrazolo-triazolopyrimidine derivatives as A2A receptor antagonists	20180408

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Related Functional Groups

Carbonyl Compounds

[51493-02-8]
N-Methyl-N-propylcarbamoyl Chloride
[1427004-19-0]
DBCO-PEG4-NHS ester
[1383427-98-2]
(S)-Hexahydropyrazino[2,1-c][1,4]oxazin-4(3H)-one hydrochloride
[959574-98-2]
(3-Phenyl-1H-pyrazol-1-yl)acetic acid
[1035840-45-9]
1-(5-Methoxy-1,3-benzoxazol-2-yl)piperidine-3-carboxylic acid
[1006443-01-1]
1-(5-Nitropyridin-2-yl)-1H-pyrazole-3-carboxylic acid

Complexity:	212
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	190.099379685
Formal Charge:	0
Heavy Atom Count:	14
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	190.099379685
Rotatable Bond Count:	2
Topological Polar Surface Area:	26.3
Undefined Atom Stereocenter Count:	1
Undefined Bond Stereocenter Count:	0
XLogP3:	2.7