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104502-45-6

104502-45-6 structure

104502-45-6 structure

Name: 5-(azepan-1-ylmethyl)-3-chloro-4,5-dimethylfuran-2-one
Chemical Name: 5-(azepan-1-ylmethyl)-3-chloro-4,5-dimethylfuran-2-one
CAS Number: 104502-45-6
Molecular Formula: C₁₃H₂₀ClNO₂
Molecular Weight: 257.75600
Create Date: 2017-03-07 12:35:32
Modify Date: 2025-08-26 21:07:02

Name	5-(azepan-1-ylmethyl)-3-chloro-4,5-dimethylfuran-2-one

Density	1.16g/cm3
Boiling Point	383.1ºC at 760mmHg
Molecular Formula	C₁₃H₂₀ClNO₂
Molecular Weight	257.75600
Flash Point	185.5ºC
Exact Mass	257.11800
PSA	29.54000
LogP	2.62860
Vapour Pressure	4.51E-06mmHg at 25°C
Index of Refraction	1.53

104502-42-3 structure

104502-42-3

~41%

104502-45-6 structure

104502-45-6

Literature: Vlasov, S. F.; Zakharevskii, A. S.; Kukharev, A. S.; Melentovich, L. A.; Tishchenko, I. G.; et al. Pharmaceutical Chemistry Journal, 1986 , vol. 20, # 10 p. 737 - 739 Khimiko-Farmatsevticheskii Zhurnal, 1986 , vol. 20, # 10 p. 1213 - 1216

Precursor 1
104502-42-3
DownStream 0

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