Products for Research Use Only

3- (2,4-dichlorophenyl) propan-1-amine

CAT: 0926-XFA49888-01Size: 250 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0926-XFA49888-01Size:250 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
CAS Number
147498-88-2
MDL Number
MFCD07374090
Smiles
C1=CC (=C (C=C1Cl) Cl) CCCN
Molecular Formula
C9H11Cl2N
Molecular Weight
204.09 g/mol
Controlled
No

Chemical Information

3-(2,4-Dichlorophenyl)propan-1-amine
CAS Number147498-88-2
PubChem CID19797638
IUPAC Name3-(2,4-dichlorophenyl)propan-1-amine
Molecular FormulaC9H11Cl2N
Molecular Weight204.09
XLogP2.9
Topological Polar Surface Area26
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count3
Heavy Atom Count12
Formal Charge0
Complexity130
SMILES
C1=CC(=C(C=C1Cl)Cl)CCCN
InChI
InChI=1S/C9H11Cl2N/c10-8-4-3-7(2-1-5-12)9(11)6-8/h3-4,6H,1-2,5,12H2
InChIKey
TYLNWUPRLIORDX-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 3-(2,4-Dichlorophenyl)propan-1-amine
CAS: 147498-88-2
CID: 19797638
Formula: C9H11Cl2N
MW: 204.09
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight204.09
XLogP32.9
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count3
Exact Mass203.0268547
Monoisotopic Mass203.0268547
Topological Polar Surface Area26 Ų
Heavy Atom Count12
Formal Charge0
Complexity130
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes