1-(4-Chlorophenyl)-1-cyclopropylmethylamine - CAS 123312-22-1

Catalog:	BB005656
Product Name:	1-(4-Chlorophenyl)-1-cyclopropylmethylamine
CAS:	123312-22-1
Synonyms:	(4-chlorophenyl)-cyclopropylmethanamine; (4-chlorophenyl)-cyclopropylmethanamine

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	(4-chlorophenyl)-cyclopropylmethanamine
Description:	1-(4-Chlorophenyl)-1-cyclopropylmethylamine (CAS# 123312-22-1) is a useful research chemical.
Molecular Weight:	181.66
Molecular Formula:	C10H12ClN
Canonical SMILES:	C1CC1C(C2=CC=C(C=C2)Cl)N
InChI:	InChI=1S/C10H12ClN/c11-9-5-3-8(4-6-9)10(12)7-1-2-7/h3-7,10H,1-2,12H2
InChI Key:	VOLXFYJGXYAYQP-UHFFFAOYSA-N
Storage:	Sealed in dry, 2-8 °C
LogP:	3.45010

Publication Number	Title	Priority Date
EP-2855488-B1	Imidazo-oxadiazole and imidazo-thiadiazole derivatives	20120605
US-10696690-B2	Imidazo-oxadiazole and imidazo-thiadiazole derivatives	20120605
US-2015175628-A1	Imidazo-oxadiazole and imidazo-thiadiazole derivatives	20120605
US-2018215770-A1	Imidazo-oxadiazole and imidazo-thiadiazole derivatives	20120605
US-9932354-B2	Imidazo-oxadiazole and imidazo-thiadiazole derivatives	20120605

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Related Functional Groups

Amines and Anilines

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[1082066-00-9]
1-Cyclopropyl-1H-pyrazole-4-carbaldehyde
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GHS Hazard Statement:	H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P260, P261, P264, P270, P271, P280, P301+P312, P301+P330+P331, P303+P361+P353, P304+P340, P305+P351+P338, P310, P312, P321, P330, P363, P403+P233, P405, and P501
Signal Word:	Danger

Complexity:	148
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	181.0658271
Formal Charge:	0
Heavy Atom Count:	12
Hydrogen Bond Acceptor Count:	1
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	181.0658271
Rotatable Bond Count:	2
Topological Polar Surface Area:	26 Å²
Undefined Atom Stereocenter Count:	1
Undefined Bond Stereocenter Count:	0
XLogP3:	2.2