Hydroxybencyclane
cis-(1R,4R)-4-benzyl-4-[3-(dimethylamino)propoxy]cycloheptan-1-ol
Also Known As: Hydroxybencyclane|KST-1A8910|GB-109|(1r,4r)-4-benzyl-4-[3-(dimethylamino)propoxy]cycloheptanol|N-((Dimethylcarbamoyl)methyl)propionanilide|Propionanilide, N-((dimethylcarbamoyl)methyl)-|Cycloheptanol, 4-(3-(dimethylamino)propoxy)-4-(phenylmethyl)-, cis-|(1R,4R)-4-benzyl-4-[3-(dimethylamino)propoxy]cycloheptan-1-ol|1-Benzyl-1-(3-N,N-dimethylaminopropoxy)-4-hydroxycycloheptane|4-Benzyl-4-[3-(dimethylamino)propoxy]cycloheptan-1-ol
| Molecular Formula | C19H31NO2 |
|---|---|
| Molecular Weight | 305.23547 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 32.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 305.23547 |
| Monoisotopic Mass | 305.23547 |
| Heavy Atoms | 22 |
| Complexity | 302.0 |
Chemical Identifiers
| CAS Number | 92033-06-2 |
|---|---|
| SMILES | CN(C)CCCO[C@@]1(CCC[C@H](CC1)O)CC2=CC=CC=C2 |
| InChIKey | UOGZUHVCOKDWIM-RTBURBONSA-N |
Product Overview
Hydroxybencyclane (CAS 92033-06-2), with molecular formula C19H31NO2 and molecular weight 305.23547 g/mol. IUPAC: cis-(1R,4R)-4-benzyl-4-[3-(dimethylamino)propoxy]cycloheptan-1-ol.
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