Basic information
- CAS
1069-31-4- Standard SMILES
Cl.NCCCC(N)(C(=O)O)C(F)F- InChIKey
VKDGNNYJFSHYKD-UHFFFAOYSA-N- Molecular formula
- C6H13ClF2N2O2
- Average molar mass
- 218.63 g/mol
- Monoisotopic mass
- 218.0633617
Overview
See also: Eflornithine (annotation moved to) ... View More ...
Names & identifiers
- Preferred name
- Eflornithine hydrochloride anhydrous
- IUPAC
- 2,5-diamino-2-(difluoromethyl)pentanoic acid;hydrochloride
- English name
- DL-Ornithine hydrochloride
- Molecular formula
- C5H13ClN2O2
- Molecular weight
- 168.62
Names & synonyms
68278-23-9Eflornithine hydrochloride anhydrous2-(Difluoromethyl)-DL-ornithine monohydrochlorideUO07O10TCJNSC-270295DTXSID601019072NSC-337250RefChem:1084052DTXCID2025765269-532-0DFMO HClDL-alpha-Difluoromethylornithine hydrochloride
Show more names
h-dl-orn-oh.hclDL-ORNITHINE MONOHYDROCHLORIDE5-15N)DL<DL-ORNITHINE HCLLABOTEST-BB LT00233116DL-ORNITHINE:HCL (15N2)DL-ORNITHINE HYDROCHLORIDEDL-ORNITHINE:HCL (ALPHA-15N)Ornithine,hydrochloride (1:1)
Vaniqa2,5-diamino-2-(difluoromethyl)pentanoic acid hydrochloride2,5-diamino-2-(difluoromethyl)pentanoic acid;hydrochlorideDFMO HCl;Eflornithine HClEflornithine (hydrochloride)MLS000069341D,L-alpha-Difluoromethylornithine hydrochlorideMFCD00274036
Database identifiers
- CAS
1069-31-4、68278-23-9、81645-68-3
Properties
Computed structural properties
- Topological polar surface area
- 89.3 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 5
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 166
Physicochemical properties
- Melting point
- 291 °C · 291 °C
- storage temp.
- Inert atmosphere,Room Temperature
- solubility
- Aqueous Acid (Slightly), Water (Slightly)
- form
- Crystalline Powder
- color
- White
- Water Solubility
- soluble
- Merck
- 14 · 14,6874
- BRN
- 4153338 · 4153338
- Stability
- Hygroscopic
- Major Application
- peptide synthesis
- InChI
- InChI=1S/C5H12N2O2.ClH/c6-3-1-2-4(7)5(8)9;/h4H,1-3,6-7H2,(H,8,9);1H
- InChIKey
- GGTYBZJRPHEQDG-UHFFFAOYSA-N
- SMILES
- C(N)(CCCN)C(=O)O.Cl
- CAS DataBase Reference
- 1069 · 1069-31-4(CAS DataBase Reference)
- EPA Substance Registry System
- Ornithine, monohydrochloride (1069-31-4)
- UNSPSC Code
- 12352209 · 12352209
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Hazard information
Regulatory InformationChemical: DL-Ornithine, monohydrochloride
Other Safety InformationEvaluation - Chemicals not considered for in depth evaluation - Not commercially active in Australia
Safety data
- F
- 3
- PPE
- Eyeshields, Gloves, type N95 (US)
- wgk
- 3
- tsca
- TSCA listed
- hs_code
- 29224985
- safety_code
- 24/25
- hazard_class
- IRRITANT
- Storage Class
- 11 - Combustible Solids
Chemistry & industry
Applications
UsesErythro-3-hydroxy-DL-ornithine monohydrochloride is used as a reagent to synthesize DL-Capreomycidine, a guanidine (HCl)-containing amino acid that is a component of antituberculous peptides.
UsesDL-Ornithine monohydrochloride may be used as a starting material in the synthesis of (-)-(1-2H)putrescine dihydrochloride via enzymatic decarboxylation.
Upstream & downstream products
Upstream raw materials
Downstream products
Suppliers100 total
国药集团化学试剂有限公司86-21-63210123 · [email protected]
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
上海康朗生物科技有限公司021-61998208 18217752821 · [email protected]
江苏生康迈翔科技有限公司18217475093 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
上海弘顺生物科技有限公司
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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