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1-(4-Fluorophenyl)cyclopropanecarboxylic Acid

1-(4-Fluorophenyl)cyclopropanecarboxylic Acid - CAS 773100-29-1

Catalog:	BB035879
Product Name:	1-(4-Fluorophenyl)cyclopropanecarboxylic Acid
CAS:	773100-29-1
Synonyms:	1-(4-fluorophenyl)-1-cyclopropanecarboxylic acid; 1-(4-fluorophenyl)cyclopropane-1-carboxylic acid

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	1-(4-fluorophenyl)cyclopropane-1-carboxylic acid
Description:	1-(4-Fluorophenyl)cyclopropanecarboxylic Acid (CAS# 773100-29-1) is a useful research chemical.
Molecular Weight:	180.18
Molecular Formula:	C10H9FO2
Canonical SMILES:	C1CC1(C2=CC=C(C=C2)F)C(=O)O
InChI:	InChI=1S/C10H9FO2/c11-8-3-1-7(2-4-8)10(5-6-10)9(12)13/h1-4H,5-6H2,(H,12,13)
InChI Key:	NGVPHOXWSFIYNV-UHFFFAOYSA-N
Boiling Point:	303.5 °C at 760 mmHg
Density:	1.361 g/cm³
MDL:	MFCD06208777
LogP:	1.94190

Publication Number	Title	Priority Date
CN-111162313-A	Polymer electrolyte and lithium ion battery	20191223
CA-3066973-A1	Modulators of indoleamine 2,3-dioxygenase	20170628
CN-110785408-A	Modulators of indoleamine2, 3-dioxygenase	20170628
EP-3645512-A1	Modulators of indoleamine 2,3-dioxygenase	20170628
WO-2019003143-A1	MODULATORS OF INDOLAMINE 2,3-DIOXYGENASE	20170628

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Related Functional Groups

Carbonyl Compounds

[91125-43-8]
Sulfophenyl nonanoate sodium salt
[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
[51493-02-8]
N-Methyl-N-propylcarbamoyl Chloride
[35153-16-3]
(Z)-10-Tetradecenyl Acetate
[70912-52-6]
1,3-Dioxane-4,6-dione,2,2-dimethyl-5-(2-pyrrolidinylidene)-
[957292-12-5]
2-(3-Cyclopropyl-1H-pyrazol-1-yl)acetic acid

GHS Hazard Statement:	H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	215
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	180.05865769
Formal Charge:	0
Heavy Atom Count:	13
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	180.05865769
Rotatable Bond Count:	2
Topological Polar Surface Area:	37.3 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.8