3-(6-Chloro-3-indolyl)-1-propanamine - CAS 1000525-46-1
Catalog: |
BB000045 |
Product Name: |
3-(6-Chloro-3-indolyl)-1-propanamine |
CAS: |
1000525-46-1 |
Synonyms: |
3-(6-chloro-1H-indol-3-yl)-1-propanamine; 3-(6-chloro-1H-indol-3-yl)propan-1-amine |
IUPAC Name: | 3-(6-chloro-1H-indol-3-yl)propan-1-amine |
Description: | 3-(6-Chloro-3-indolyl)-1-propanamine (CAS# 1000525-46-1 ) is a useful research chemical. |
Molecular Weight: | 208.69 |
Molecular Formula: | C11H13ClN2 |
Canonical SMILES: | C1=CC2=C(C=C1Cl)NC=C2CCCN |
InChI: | InChI=1S/C11H13ClN2/c12-9-3-4-10-8(2-1-5-13)7-14-11(10)6-9/h3-4,6-7,14H,1-2,5,13H2 |
InChI Key: | UPJOMHTVSMFSRN-UHFFFAOYSA-N |
LogP: | 3.41290 |
Complexity: | 186 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 208.0767261 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 208.0767261 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 41.8 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.8 |
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