7-Fluoro-1-tetralone - CAS 2840-44-0

Catalog:	BB019844
Product Name:	7-Fluoro-1-tetralone
CAS:	2840-44-0
Synonyms:	7-fluoro-3,4-dihydro-2H-naphthalen-1-one

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	7-fluoro-3,4-dihydro-2H-naphthalen-1-one
Description:	7-Fluoro-1-tetralone (CAS# 2840-44-0) is a useful research chemical.
Molecular Weight:	164.18
Molecular Formula:	C10H9FO
Canonical SMILES:	C1CC2=C(C=C(C=C2)F)C(=O)C1
InChI:	InChI=1S/C10H9FO/c11-8-5-4-7-2-1-3-10(12)9(7)6-8/h4-6H,1-3H2
InChI Key:	UCBYBFAJSWCTLG-UHFFFAOYSA-N
Boiling Point:	258.1 °C at 760 mmHg
Purity:	95 %
Density:	1.198 g/cm³
MDL:	MFCD07375433
LogP:	2.34470

Publication Number	Title	Priority Date
CN-111116436-A	Synthetic method of thioether compound containing 1, 4-naphthoquinone structure	20200117
CN-111116436-B	Synthetic method of thioether compound containing 1, 4-naphthoquinone structure	20200117
WO-2021113808-A1	Cftr-modulating arylamides	20191205
WO-2021097139-A1	Chiral synthesis of a tertiary alcohol	20191115
WO-2021041671-A1	Kras g12d inhibitors	20190829

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Related Functional Groups

Carbonyl Compounds

[89908-23-6]
2-Propenoic acid, 2-(3',3'-dimethyl-6-nitrospiro[2H-1-benzopyran-2,2'-[2H]indol]-1'(3'H)-yl)ethyl ester
[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
[832741-29-4]
1-(4-Bromo-5-propylthiophen-2-yl)ethanone
[253429-30-0]
1-Bromo-2-(2,2-diethoxyethoxy)-4-fluorobenzene
[1018125-51-3]
2-(6-Ethyl-3-methyl-4-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridin-1-yl)acetic acid

Fluorinated Building Blocks

[1866059-82-6]
1,1,2,2-Tetrafluoro-3-methylsulfonylpropane
[1018125-51-3]
2-(6-Ethyl-3-methyl-4-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridin-1-yl)acetic acid
[1170836-29-9]
3-(1',3'-Dimethyl-5-(trifluoromethyl)-1'H,2H-[3,4'-bipyrazol]-2-yl)propanenitrile
[1795420-51-7]
3-Amino-1-(2,2,2-trifluoroethyl)pyrazole-4-carboxylic acid
[927800-47-3]
4-Chloro-6-fluoro-2-trichloromethyl-quinoline
[5310-68-9]
4-Chlorophenylsulphur pentafluoride

Other Pyrimidines

[2367-82-0]
1,2,3,5-Tetrafluorobenzene
[479552-94-8]
1H-Pyrrolo[2,3-b]pyridin-4-yl trifluoromethanesulfonate
[1183749-69-0]
2-(pyrimidin-2-yloxy)phenol
[937601-34-8]
3-Bromo-2,5-dimethylpyrazolo[1,5-a]pyrimidine-7-carboxylic acid
[832739-73-8]
4-(3,5-Dichlorophenyl)pyrimidine-2-thiol
[927800-47-3]
4-Chloro-6-fluoro-2-trichloromethyl-quinoline

GHS Hazard Statement:	H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P264, P270, P301+P312, P330, and P501
Signal Word:	Warning

Complexity:	190
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	164.063743068
Formal Charge:	0
Heavy Atom Count:	12
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	164.063743068
Rotatable Bond Count:	0
Topological Polar Surface Area:	17.1 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.1