Shanghai Nianxing Industrial Co., Ltd
China
Product Name: Theobromine-D6
Price: Check
Purity: 99.0%
Stocking Period: 10 Day
Contact: Yang
Email: sales@echemcloud.com

117490-40-1

117490-40-1 structure

117490-40-1 structure

Name: Theobromine-d6
Chemical Name: 3,7-bis(trideuteriomethyl)purine-2,6-dione
CAS Number: 117490-40-1
Molecular Formula: C₇H₂D₆N₄O₂
Molecular Weight: 186.20100
Create Date: 2018-08-01 00:26:36
Modify Date: 2025-08-21 18:53:31

Name	3,7-bis(trideuteriomethyl)purine-2,6-dione
Synonyms	3,7-Dimethylxanthine-d6 Theobromine-d6 Teobromin-d6 Santheose-d6 Thesal-d6 Diurobromine-d6

Description

Melting Point	>300ºC
Molecular Formula	C₇H₂D₆N₄O₂
Molecular Weight	186.20100
Exact Mass	186.10200
PSA	72.68000
Index of Refraction	1.737
Storage condition	-20°C

Symbol	GHS07
Signal Word	Warning
Hazard Statements	H302
Hazard Codes	Xi
RIDADR	NONH for all modes of transport

865-50-9 structure

865-50-9

18641-05-9 structure

18641-05-9

~%

1185878-99-2 structure

1185878-99-2

117490-40-1 structure

117490-40-1

Literature: US2009/239886 A1, ; Page/Page column 27 ; US 20090239886 A1

69-89-6 structure

69-89-6

~%

1185878-99-2 structure

1185878-99-2

117490-40-1 structure

117490-40-1

Literature: WO2011/28835 A1, ;

Precursor 3
865-50-9 18641-05-9 69-89-6
DownStream 1
1185878-98-1

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