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6,7,8,9-Tetrahydro-5H-benzo[7]annulene-5-carboxylic Acid

6,7,8,9-Tetrahydro-5H-benzo[7]annulene-5-carboxylic Acid - CAS 14378-56-4

Catalog:	BB009668
Product Name:	6,7,8,9-Tetrahydro-5H-benzo[7]annulene-5-carboxylic Acid
CAS:	14378-56-4
Synonyms:	6,7,8,9-tetrahydro-5H-benzo[7]annulene-5-carboxylic acid; 6,7,8,9-tetrahydro-5H-benzo[7]annulene-5-carboxylic acid

Technical Data

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Computed Properties

IUPAC Name:	6,7,8,9-tetrahydro-5H-benzo[7]annulene-5-carboxylic acid
Description:	6,7,8,9-Tetrahydro-5H-benzo[7]annulene-5-carboxylic Acid (CAS# 14378-56-4) is a useful research chemical.
Molecular Weight:	190.24
Molecular Formula:	C12H14O2
Canonical SMILES:	C1CCC2=CC=CC=C2C(C1)C(=O)O
InChI:	InChI=1S/C12H14O2/c13-12(14)11-8-4-2-6-9-5-1-3-7-10(9)11/h1,3,5,7,11H,2,4,6,8H2,(H,13,14)
InChI Key:	IWWVDVJJFIJZQE-UHFFFAOYSA-N

Publication Number	Title	Priority Date
WO-2017123518-A1	Aminotriazole immunomodulators for treating autoimmune diseases	20160111
US-2009118283-A1	Amide Derivatives as Kinase Inhibitors	20050711
US-2010168102-A9	Amide Derivatives as Kinase Inhibitors	20050711
WO-2007006546-A1	Amide derivatives as kinase inhibitors	20050711
US-2005054630-A1	Fused bicyclic carboxamide derivatives and methods of their use	20030828

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Related Functional Groups

Carbonyl Compounds

[91125-43-8]
Sulfophenyl nonanoate sodium salt
[5650-34-0]
Oxiran-2-yl(phenyl)methanone
[51493-02-8]
N-Methyl-N-propylcarbamoyl Chloride
[1018141-88-2]
1-(2-Cyanoethyl)-3-methyl-6-phenyl-1H-pyrazolo[3,4-b]pyridine-4-carboxylic acid
[91552-11-3]
2-(3-Chlorophenyl)cyclopropanecarboxylic Acid
[927676-51-5]
2-(6-Bromo-3-indolyl)-2-oxoacetic Acid

GHS Hazard Statement:	H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
Precautionary Statement:	P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word:	Warning

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:	1
Isotope Atom Count:	0
Monoisotopic Mass:	190.099379685
Rotatable Bond Count:	1
Topological Polar Surface Area:	37.3 Å²
Undefined Atom Stereocenter Count:	1
Undefined Bond Stereocenter Count:	0
XLogP3:	2.9