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N-(2,4,5-Trimethoxybenzyl)Cycloheptanamine
[CAS# 418778-25-3]

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Identification
Name N-(2,4,5-Trimethoxybenzyl)Cycloheptanamine
Synonyms N-(2,4,5-trimethoxybenzyl)cycloheptanamine; BAS 03049807; MLS000061049
Molecular Structure CAS#: 418778-25-3, N-(2,4,5-Trimethoxybenzyl)Cycloheptanamine
Molecular Formula C17H27NO3
Molecular Weight 293.40
CAS Registry Number 418778-25-3
SMILES COC1=CC(=C(C=C1CNC2CCCCCC2)OC)OC
InChI 1S/C17H27NO3/c1-19-15-11-17(21-3)16(20-2)10-13(15)12-18-14-8-6-4-5-7-9-14/h10-11,14,18H,4-9,12H2,1-3H3
InChIKey XMPQULBLBNXUGO-UHFFFAOYSA-N
Properties
Density 1.1±0.1g/cm3 (Cal.)
Boiling point 410.1±40.0°C at 760 mmHg (Cal.)
Flash point 176.3±16.8°C (Cal.)
Refractive index 1.522 (Cal.)
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