Basic information
- CAS
40616-75-9- Standard SMILES
CC[NH+](CCCl)Cc1ccccc1Br.[Cl-]- InChIKey
NDDRNRRNYOULND-UHFFFAOYSA-N- Molecular formula
- C11H16BrCl2N
- Average molar mass
- 313.06 g/mol
- Monoisotopic mass
- 310.98432
Overview
See other relationships...
Names & identifiers
- Preferred name
- BENZYLAMINE, o-BROMO-N-(2-CHLOROETHYL)-N-ETHYL-, HYDROCHLORIDE
- IUPAC
- (2-bromophenyl)methyl-(2-chloroethyl)-ethylazanium chloride
- English name
- N-(2-Chloroethyl)-N-ethyl-2-bromobenzylamine hydrochloride
- Molecular formula
- C11H16BrCl2N
- Molecular weight
- 313.06
Names & synonyms
BENZYLAMINE, o-BROMO-N-(2-CHLOROETHYL)-N-ETHYL-, HYDROCHLORIDEo-Bromo-N-(2-chloroethyl)-N-ethylbenzylamine hydrochloride(2-bromophenyl)methyl-(2-chloroethyl)-ethylazanium;chlorideDSP-4DSP-4 HClDSP-4 HCl ，S0896DSP-4 HYDROCHLORIDENeurotoxin DSP 4 (hydrochloride)DSP-4 hydrochloride, 10 mM in DMSON-(2-CHLOROETHYL)-N-ETHYL-2-BROMOBENZYL&2-BROMO-N-(2-CHLOROETHYL)-ETHYLBENZYLAMINEN-(2-CHLOROETHYL)-N-ETHYL-2'-BROMOBENZYLAMINO HCL
Show more names
N-(2-CHLOROETHYL)-N-ETHYL-2'-BROMOBENZYLAMINE HCL
Database identifiers
- CAS
40616-75-9- PubChem CID
- 38533
Properties
Computed structural properties
- Topological polar surface area
- 4.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 5
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 154
Physicochemical properties
- storage temp.
- Inert atmosphere,Room Temperature
- solubility
- 2 O: · H2O: soluble48mg/mL
- form
- solid
- color
- white
- Water Solubility
- 2 O: · H2O: 48mg/mL0.1 M NaOH: 7mg/mLethanol: soluble
- BRN
- 4020910 · 4020910
- InChI
- 1S/C11H15BrClN.ClH/c1-2-14(8-7-13)9-10-5-3-4-6-11(10)12;/h3-6H,2,7-9H2,1H3;1H
- InChIKey
- NDDRNRRNYOULND-UHFFFAOYSA-N
- SMILES
- Cl[H].CCN(CCCl)Cc1ccccc1Br
- FDA UNII
- 1 P7JP5C1 · PQ1P7JP5C1
- UNSPSC Code
- 12352116 · 12352116
- NACRES
- 77 · NA.77
- PPE
- 95 · Eyeshields, Gloves, type N95 (US)
- WGK Germany
- 3 · 3
- RTECS
- 1726100 · DP1726100
- F
- 3 · 3-10
- Storage Class
- 11 · 11 - Combustible Solids
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- F
- 3-10
- PPE
- Eyeshields, Gloves, type N95 (US)
- wgk
- 3
- rtecs
- DP1726100
- Storage Class
- 11 - Combustible Solids
Chemistry & industry
Applications
UsesDSP-4 Hydrochloride is an adrenergic neuron blocking agent with inhibitory effects on the uptake of noradrenaline.
Suppliers39 total
Sichuan Biosynce Pharmatech Co., Ltd.[email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
Compound Net Biotechnology Inc.15266686121 · [email protected]
北京索莱宝科技有限公司010-50973130 17801761073 · [email protected]
武汉易泰科技有限公司上海分公司18930552037 · [email protected]
InvivoChem中国13549236410 · [email protected]
怀化市冰峰化工有限公司0745-2866851 17711757908 · [email protected]
上海毕得医药科技股份有限公司400-164-7117 18317119277 · [email protected]
天津普西唐生物医药科技有限公司010-60605840 · [email protected]
Sigma-Aldrich西格玛奥德里奇(上海)贸易有限公司021-61415566 800-8193336 · [email protected]
上海陶术生物科技股份有限公司+1-781-999-5354; +1-00000000000 · [email protected]
BOC Sciences16314854226; +8616314854226 · [email protected]
Related reactions
0 records
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Compound notes
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