2- (4-Chlorophenoxy) -benzylamine

CAT: 0127-OR452224-01Size: 500 mgDry Ice: NoHazardous: No

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CAT#:0127-OR452224-01Size:500 mg

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CAS Number

792158-57-7

MDL Number

MFCD11191890

Purity

97%

Smiles

NCc1ccccc1Oc2ccc(Cl)cc2

Chemical Information

(2-(4-chlorophenoxy)phenyl)MethanaMine

CAS Number	792158-57-7
PubChem CID	19926667
IUPAC Name	[2-(4-chlorophenoxy)phenyl]methanamine
Molecular Formula	C13H12ClNO
Molecular Weight	233.69
XLogP	2.9
Topological Polar Surface Area	35.3
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	3
Heavy Atom Count	16
Formal Charge	0
Complexity	204

SMILES

C1=CC=C(C(=C1)CN)OC2=CC=C(C=C2)Cl

InChI

InChI=1S/C13H12ClNO/c14-11-5-7-12(8-6-11)16-13-4-2-1-3-10(13)9-15/h1-8H,9,15H2

InChIKey

IAXVDWCOADTYIX-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 792158-57-7

CID: 19926667

Formula: C13H12ClNO

MW: 233.69

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	233.69
XLogP3	2.9
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	3
Exact Mass	233.0607417
Monoisotopic Mass	233.0607417
Topological Polar Surface Area	35.3 Å²
Heavy Atom Count	16
Formal Charge	0
Complexity	204
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
OR12956	4- (2-Chlorophenoxy) benzylamine hydrochloride
PC109833-01	4- (4-Chlorophenoxy) -2- (trifluoromethyl) benzenamine
PC530060-01	2- (4-Fluorophenoxy) -benzylamine
OR1029457-01	2- (4-Chlorophenoxy) Ethanol
OR1101087-01	2- (4-Chlorophenoxy) -α-methylbenzenemethanol
OR11360-01	4- (2-Chlorophenoxy) iodobenzene
OR15159-01	2- (4-Chlorophenoxy) nicotinaldehyde
OR91108-01	2- (4-Chlorophenoxy) benzaldehyde
OR16163	2- (4-Chlorophenoxy) ethylamine
OR11348-01	4- (2-Chlorophenoxy) aniline

Catalog	Name
sc-473469	4- (2-Chlorophenoxy) Benzylamine Hydrochloride
232425-01	4- (2-Chlorophenoxy) Benzylamine Hydrochloride ≥90% (HPLC)
EFB92030	4- (Difluoromethyl) benzylamine
YLB13847-01	4- (Morpholinocarbonyl) benzylamine
429459-01	4- (Cyclopentyloxy) benzylamine
sc-232324A	4- (Trifluoromethyl) benzylamine
029115-01	4-Bromo Benzylamine
sc-232312	4- (Trifluoromethoxy) benzylamine
sc-226450	4- (Trifluoromethylthio) benzylamine
sc-267149	4- (Difluoromethoxy) benzylamine