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1-(4-Methoxyphenyl)cyclopropane-1-methanamine

1-(4-Methoxyphenyl)cyclopropane-1-methanamine - CAS 75180-45-9

Catalog:	BB035264
Product Name:	1-(4-Methoxyphenyl)cyclopropane-1-methanamine
CAS:	75180-45-9
Synonyms:	[1-(4-methoxyphenyl)cyclopropyl]methanamine; [1-(4-methoxyphenyl)cyclopropyl]methanamine

Technical Data

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Computed Properties

IUPAC Name:	[1-(4-methoxyphenyl)cyclopropyl]methanamine
Description:	1-(4-Methoxyphenyl)cyclopropane-1-methanamine (CAS# 75180-45-9) is a useful research chemical.
Molecular Weight:	177.24
Molecular Formula:	C11H15NO
Canonical SMILES:	COC1=CC=C(C=C1)C2(CC2)CN
InChI:	InChI=1S/C11H15NO/c1-13-10-4-2-9(3-5-10)11(8-12)6-7-11/h2-5H,6-8,12H2,1H3
InChI Key:	MHMAVRWOZLLFQF-UHFFFAOYSA-N
LogP:	2.38580

Publication Number	Title	Priority Date
AU-2014304046-A1	Benzimidazolyl-methyl urea derivatives as ALX receptor agonists	20130809
AU-2014304046-B2	Benzimidazolyl-methyl urea derivatives as ALX receptor agonists	20130809
CA-2917954-A1	Benzimidazolyl-methyl urea derivatives as alx receptor agonists	20130809
EP-3030560-A1	Benzimidazolyl-methyl urea derivatives as alx receptor agonists	20130809
KR-20160042019-A	Benzimidazolyl-methyl urea derivatives as alx receptor agonists	20130809

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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:	169
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	177.115364102
Formal Charge:	0
Heavy Atom Count:	13
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	177.115364102
Rotatable Bond Count:	3
Topological Polar Surface Area:	35.2 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.5