1-(4-Fluorophenyl)cyclopropanemethanamine - CAS 75180-46-0

Catalog:	BB035265
Product Name:	1-(4-Fluorophenyl)cyclopropanemethanamine
CAS:	75180-46-0
Synonyms:	[1-(4-fluorophenyl)cyclopropyl]methanamine; [1-(4-fluorophenyl)cyclopropyl]methanamine

Technical Data

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Computed Properties

IUPAC Name:	[1-(4-fluorophenyl)cyclopropyl]methanamine
Description:	1-(4-Fluorophenyl)cyclopropanemethanamine (CAS# 75180-46-0) is a useful research chemical.
Molecular Weight:	165.21
Molecular Formula:	C10H12FN
Canonical SMILES:	C1CC1(CN)C2=CC=C(C=C2)F
InChI:	InChI=1S/C10H12FN/c11-9-3-1-8(2-4-9)10(7-12)5-6-10/h1-4H,5-7,12H2
InChI Key:	LIZUFNBWJGVYRB-UHFFFAOYSA-N
MDL:	MFCD06213570
LogP:	2.51630

Publication Number	Title	Priority Date
US-2020405706-A1	Tetrahydroquinoline derivatives as p2x7 receptor antagonists	20170313
US-2021085667-A1	Tetrahydroquinoline derivatives as p2x7 receptor antagonists	20170313
US-11077100-B2	Tetrahydroquinoline derivatives as P2X7 receptor antagonists	20170313
EP-2825538-A1	Positive allosteric modulators of mglur2	20120316
EP-2825538-B1	Positive allosteric modulators of mglur2	20120316

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Related Functional Groups

Amines and Anilines

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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, P310, P312, P321, P330, P332+P313, P362, P403+P233, P405, and P501
Signal Word:	Danger

Complexity:	157
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	165.095377549
Formal Charge:	0
Heavy Atom Count:	12
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	165.095377549
Rotatable Bond Count:	2
Topological Polar Surface Area:	26 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.6