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Basic information
- CAS
54749-91-6- Standard SMILES
O=NN(C(=O)NCCCl)C1CCCCC1- InChIKey
IGMMTYZWNUSEEU-UHFFFAOYSA-N- Molecular formula
- C9H16ClN3O2
- Average molar mass
- 233.699 g/mol
- Monoisotopic mass
- 233.09310443
Names & identifiers
- Preferred name
- Urea, 1-(2-chloroethyl)-3-cyclohexyl-3-nitroso-
- IUPAC
- N'-(2-Chloroethyl)-N-cyclohexyl-N-nitrosourea
- English name
- N-Denitroso-N'-nitroso LoMustine
- Molecular formula
- C9H16ClN3O2
- Molecular weight
- 233.7
Names & synonyms
3-(2-chloroethyl)-1-cyclohexyl-1-nitrosoureaLomustine USP RC DLoMustine Related CoMpound DN-Denitroso-N'-nitroso LoMustineN'-Nitroso Lomustine EP Impurity BN-Denitroso-N′-nitroso Lomustine, CAS 54749-91-6Lomustine Related Compound D (3-(2-Chloroethyl)-1-cyclohexyl-1-nitrosourea) (1369453)
Database identifiers
- CAS
54749-91-6- PubChem CID
- 3041706
- DTXSID
DTXSID30203209- UNII
- 3PU8X9N1UI
- Nikkaji
- J60.484D
Properties
Physicochemical properties
- Melting point
- 73 ℃ · 73℃ (decomposition)
- storage temp.
- 2 · 2-8°C
- Major Application
- pharmaceutical (small molecule)
- InChI
- 1S/C9H16ClN3O2/c10-6-7-11-9(14)13(12-15)8-4-2-1-3-5-8/h8H,1-7H2,(H,11,14)
- InChIKey
- IGMMTYZWNUSEEU-UHFFFAOYSA-N
- SMILES
- ClCCNC(=O)N(N=O)C1CCCCC1
- FDA UNII
- 3 PU8X9N1UI · 3PU8X9N1UI
- UNSPSC Code
- 41116107 · 41116107
- NACRES
- 24 · NA.24
- HS Code
- 2929909000 · 2929909000
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
- hs_code
- 2929909000
Chemistry & industry
Applications
UsesAn isomeric impurity of Lomustine (L469440) with antitumor activity.
Upstream & downstream products
Upstream raw materials
Suppliers9 total
广州隽沐生物科技股份有限公司020-36607679; 13502246435 · [email protected]
安耐吉化学&3A（安徽泽升科技有限公司）021-58432009 400-005-6266 · [email protected]
凯试(上海)科技有限公司021-50135380 · [email protected]
河南誉康卓宁进出口有限公司13393721940 · [email protected]
上海康满林生物医药有限公司68080707 15021879576 · [email protected]
深圳聚合生化科技有限公司+86-400-002-6226 · [email protected]
梯尔希（南京）药物研发有限公司18012923235 18012923235 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
湖北清北云研医药科技有限责任公司18162595016; 18162595016 · [email protected]
Related reactions
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Compound notes
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