1-(3,4-Dihydroisoquinolin-2(1H)-yl)propan-2-amine - CAS 54151-52-9
Catalog: |
BB028529 |
Product Name: |
1-(3,4-Dihydroisoquinolin-2(1H)-yl)propan-2-amine |
CAS: |
54151-52-9 |
Synonyms: |
1-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-amine |
IUPAC Name: | 1-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-amine |
Description: | 1-(3,4-Dihydroisoquinolin-2(1H)-yl)propan-2-amine (CAS# 54151-52-9) is a useful research chemical. |
Molecular Weight: | 190.28 |
Molecular Formula: | C12H18N2 |
Canonical SMILES: | CC(CN1CCC2=CC=CC=C2C1)N |
InChI: | InChI=1S/C12H18N2/c1-10(13)8-14-7-6-11-4-2-3-5-12(11)9-14/h2-5,10H,6-9,13H2,1H3 |
InChI Key: | KUENUWACNZYNKC-UHFFFAOYSA-N |
Boiling Point: | 299.7 °C at 760 mmHg |
Density: | 1.025 g/cm3 |
MDL: | MFCD08059715 |
LogP: | 2.03010 |
GHS Hazard Statement: | H400 (97.44%): Very toxic to aquatic life [Warning Hazardous to the aquatic environment, acute hazard] |
Precautionary Statement: | P273, P391, and P501 |
Signal Word: | Warning |
Complexity: | 181 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 190.146998583 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 190.146998583 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 29.3 Å2 |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.3 |
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