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830-93-3

830-93-3 structure
830-93-3 structure
  • Name: 5-Bromogramine
  • Chemical Name: 1-(5-bromo-1H-indol-3-yl)-N,N-dimethylmethanamine
  • CAS Number: 830-93-3
  • Molecular Formula: C11H13BrN2
  • Molecular Weight: 253.13800
  • Create Date: 2018-09-12 10:37:34
  • Modify Date: 2024-01-09 19:29:18

Name 1-(5-bromo-1H-indol-3-yl)-N,N-dimethylmethanamine
Synonyms BROMOGRAMINE
(5-Brom-indol-3-ylmethyl)-dimethyl-amin
INDOLE,5-BROMO-3-(DIMETHYLAMINO)METHYL
5-Bromo-N,N-dimethyl-1H-Indole-3-methanamine
MFCD00055980
5-Bromogramine
5-bromo-3-(N,N-dimethylamino)methylindole
N-[(5-bromo-1H-indol-3-yl)methyl]-N,N-dimethylamine
(5-bromo-indol-3-ylmethyl)-dimethyl-amine
Density 1.449 g/cm3
Boiling Point 346.9ºC at 760 mmHg
Melting Point 158-162 °C
Molecular Formula C11H13BrN2
Molecular Weight 253.13800
Flash Point 163.6ºC
Exact Mass 252.02600
PSA 19.03000
LogP 2.99200
Index of Refraction 1.655

CHEMICAL IDENTIFICATION

RTECS NUMBER :
NL5170000
CHEMICAL NAME :
Indole, 5-bromo-3-(dimethylamino)methyl-
CAS REGISTRY NUMBER :
830-93-3
BEILSTEIN REFERENCE NO. :
0160259
LAST UPDATED :
199612
DATA ITEMS CITED :
2
MOLECULAR FORMULA :
C11-H13-Br-N2
MOLECULAR WEIGHT :
253.17
WISWESSER LINE NOTATION :
T56 BMJ D1N1&1 GE

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
75 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
PSYPAG Psychopharmacologia (Berlin). (Berlin, Ger.) V.1-46, 1959-76. For publisher information, see PSCHDL. Volume(issue)/page/year: 16,385,1970
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
56 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
CSLNX* U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. (Aberdeen Proving Ground, MD 21010) Volume(issue)/page/year: NX#00242
Symbol GHS07
GHS07
Signal Word Warning
Hazard Statements H302-H315-H319-H335
Precautionary Statements P261-P305 + P351 + P338
Personal Protective Equipment dust mask type N95 (US);Eyeshields;Gloves
Hazard Codes Xn
Risk Phrases 22-36/37/38
Safety Phrases 26
RIDADR NONH for all modes of transport
HS Code 2933990090

~88%

830-93-3 structure

830-93-3

Literature: Li, Shi-Guang; Zard, Samir Z. Organic Letters, 2013 , vol. 15, # 22 p. 5898 - 5901

~93%

830-93-3 structure

830-93-3

Literature: DUKE UNIVERSITY Patent: WO2006/102126 A2, 2006 ; Location in patent: Page/Page column 25 ; WO 2006/102126 A2

~63%

830-93-3 structure

830-93-3

Literature: Todd, Robert; Hossain, M. Mahmun Synthesis, 2009 , # 11 art. no. M07508SS, p. 1846 - 1850

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830-93-3 structure

830-93-3

Literature: Organic and Biomolecular Chemistry, , vol. 10, # 10 p. 2101 - 2112

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830-93-3 structure

830-93-3

Literature: European Journal of Medicinal Chemistry, , vol. 18, # 3 p. 261 - 268
HS Code 2933990090
Summary 2933990090. heterocyclic compounds with nitrogen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%