1- (2,4-Dichlorophenyl) propan-1-amine

CAT: 0127-OR1039546-01Size: 100 mgDry Ice: NoHazardous: No

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CAT#:0127-OR1039546-01Size:100 mg

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CAS Number

1141405-05-1

MDL Number

MFCD12180258

Purity

97%

Smiles

ClC1=CC=C(C(CC)N)C(Cl)=C1

Chemical Information

1-(2,4-Dichlorophenyl)propan-1-amine

CAS Number	1141405-05-1
PubChem CID	43417082
IUPAC Name	1-(2,4-dichlorophenyl)propan-1-amine
Molecular Formula	C9H11Cl2N
Molecular Weight	204.09
XLogP	3
Topological Polar Surface Area	26
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	2
Heavy Atom Count	12
Formal Charge	0
Complexity	140

SMILES

CCC(C1=C(C=C(C=C1)Cl)Cl)N

InChI

InChI=1S/C9H11Cl2N/c1-2-9(12)7-4-3-6(10)5-8(7)11/h3-5,9H,2,12H2,1H3

InChIKey

UGADEKOSKBRAKG-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 1141405-05-1

CID: 43417082

Formula: C9H11Cl2N

MW: 204.09

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	204.09
XLogP3	3
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	2
Exact Mass	203.0268547
Monoisotopic Mass	203.0268547
Topological Polar Surface Area	26 Å²
Heavy Atom Count	12
Formal Charge	0
Complexity	140
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
OR1058245-01	1- (3,4-Dichlorophenyl) propan-1-amine
OR91673	2- (2,4-Dichlorophenyl) propan-2-amine hydrochloride
OR1008895-01	1- (2,4-Dichlorophenyl) Propan-1-One
OR1033636-01	1- (2,4-Dichlorophenyl) propan-2-ol
OR1049073-01	(S) -1- (2,6-Dichlorophenyl) propan-1-amine hydrochloride
OR1049445-01	(R) -1- (2,6-Dichlorophenyl) propan-1-amine hydrochloride
OR1009716-01	2- (3,5-Dichlorophenyl) Propan-2-Amine
OR1065815-01	(R) -1- (3,5-Dichlorophenyl) propan-1-amine hydrochloride
OR86807-01	1- (3,4-Dichlorophenyl) prop-2-en-1-amine
OR81895-01	1- (2,4-Dichlorophenyl) ethan-1-amine hydrochloride

Catalog	Name
HBA56077-01	1- (2,4-Dichlorophenyl) propan-2-amine
XFA49888-01	3- (2,4-dichlorophenyl) propan-1-amine
RDA89684-01	2- (3,4-Dichlorophenyl) propan-2-amine
PDA65571-01	2- (2,6-Dichlorophenyl) propan-1-amine
DHA06333-01	3- (2,6-Dichlorophenyl) propan-1-amine
YGC03317-01	1- (2,6-Dichlorophenyl) propan-2-amine hydrochloride
UCA95782-01	[ (3,4-Dichlorophenyl) methyl] (propan-2-yl) amine
PBA95989-01	3- (3,4-Dichlorophenyl) propan-1-amine hydrochloride
QZB52865-01	2- (2,6-Dichlorophenyl) propan-2-amine hydrochloride
SGC63835	2- (3,5-Dichlorophenyl) propan-2-amine hydrochloride