2- (4-Chlorophenyl) -2-methoxyethan-1-amine

CAT: 0926-CYB89094-01Size: 100 mgDry Ice: NoHazardous: No

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CAT#:0926-CYB89094-01Size:100 mg

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CAS Number

1202890-94-5

MDL Number

MFCD16062116

Smiles

COC (CN) C1=CC=C (C=C1) Cl

Molecular Formula

C9H12ClNO

Molecular Weight

185.65 g/mol

Controlled

Chemical Information

2-(4-Chlorophenyl)-2-methoxyethan-1-amine

CAS Number	1202890-94-5
PubChem CID	53276240
IUPAC Name	2-(4-chlorophenyl)-2-methoxyethanamine
Molecular Formula	C9H12ClNO
Molecular Weight	185.65
XLogP	1.3
Topological Polar Surface Area	35.3
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	3
Heavy Atom Count	12
Formal Charge	0
Complexity	124

SMILES

COC(CN)C1=CC=C(C=C1)Cl

InChI

InChI=1S/C9H12ClNO/c1-12-9(6-11)7-2-4-8(10)5-3-7/h2-5,9H,6,11H2,1H3

InChIKey

UBRQWTFQGAAMGA-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 1202890-94-5

CID: 53276240

Formula: C9H12ClNO

MW: 185.65

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	185.65
XLogP3	1.3
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	3
Exact Mass	185.0607417
Monoisotopic Mass	185.0607417
Topological Polar Surface Area	35.3 Å²
Heavy Atom Count	12
Formal Charge	0
Complexity	124
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
RQA23375-01	1- (4-Chlorophenyl) -2-methoxyethan-1-amine
XZB61912-01	1- (3-Chlorophenyl) -2-methoxyethan-1-amine
UFC04063-01	2- (2-Chlorophenyl) -2-methoxyethan-1-amine hydrochloride
FBA78045-01	1- (4-Chlorophenyl) -2-methoxyethan-1-one
DNB71526-01	1- (4-Ethoxyphenyl) -2-methoxyethan-1-amine
WMA83991-01	1- (4-Fluorophenyl) -2-methoxyethan-1-amine
MCA06469-01	2- (4-Fluorophenyl) -2-methoxyethan-1-amine hydrochloride
TJC60921-01	2-Cyclopentyl-2-methoxyethan-1-amine
TJC31487-01	2-Cyclohexyl-2-methoxyethan-1-amine
EEC96382-01	1- (4-Fluorophenyl) -2-methoxyethan-1-amine hydrochloride

Catalog	Name
OR1035711-01	1- (4-Chlorophenyl) -2-methoxyethan-1-amine
OR78458-01	1- (4-Chlorophenyl) -2-methoxyethan-1-one
PC100861-01	1- (4-Fluorophenyl) -2-methoxyethan-1-amine hydrochloride
OR1034495-01	(S) -1- (4-Bromophenyl) -2-methoxyethan-1-amine
PC1003521-01	(S) -1- (4-fluorophenyl) -2-methoxyethan-1-amine hydrochloride
PC101959	1- (3-Fluoro-4- (trifluoromethoxy) phenyl) -2-methoxyethan-1-amine hydrochloride
413710-01	2- (4-Chlorophenyl) -2-methylpropan-1-amine
408072-01	1- (4-Chlorophenyl) -2-methylpropan-1-amine
OR4928	4- (4-Chlorophenyl) pyrimidin-2-amine
HY-W052190-01	4- (4-chlorophenyl) thiazol-2-amine