Basic information
- CAS
14504-75-7- Standard SMILES
O=P(O)(NCCCO)N(CCCl)CCCl- InChIKey
FYMCFKPEIMXMOB-UHFFFAOYSA-N- Molecular formula
- C7H17Cl2N2O3P
- Average molar mass
- 279.1 g/mol
- Monoisotopic mass
- 278.0353848
Overview
Cytoxal alcohol is a colorless powder. (NTP, 1992)
Names & identifiers
- Preferred name
- Cytoxal alcohol
- IUPAC
- bis(2-chloroethyl)amino-(3-hydroxypropylamino)phosphinic acid
- English name
- CYTOXALALCOHOL
- Molecular formula
- C7H17Cl2N2O3P
- Molecular weight
- 279.1
Names & synonyms
CYTOXAL ALCOHOLCytoxyl alcoholUNII-6TG30F4XMK6TG30F4XMKBRN 2416302DTXSID2043791RefChem:130452DTXCID00237912-(BIS(2-CHLOROETHYL)AMINO)TETRAHYDROOXAZAPHOSPHORINE CYCLOHEXYLAMINE SALTN,N-BIS(2-CHLOROETHYL)-N'(3-HYDROXYPROPYL)PHOSPHORODIAMIDIC ACID CYCLO-HEXYLAMINE SALTN,N-BIS(2-CHLOROETHYL)-N'-(3-HYDROXYPROPYL)PHOSPHORODIAMIDATE, CYCLO-HEXYLAMMONIUM SALTPHOSPHORODIAMIDIC ACID, N,N-BIS(2-CHLOROETHYL)-N'(3-HYDROXYPROPYL)CYCLO-HEXYL AMINE SALT
Show more names
NCI-C04922Cytoxan alcohol14504-75-7CYTOXALALCOHOLbis(2-chloroethyl)amino-(3-hydroxypropylamino)phosphinic acidN,N-Bis(2-chloroethyl)-N'-(3-hydroxypropyl)phosphorodiamidic acidPhosphorodiamidic acid, N,N-bis(2-chloroethyl)-N'-(3-hydroxypropyl)-Cyclophosphamide Impurity 54
Database identifiers
- CAS
14504-75-7- PubChem CID
- 20530
- DTXSID
Properties
Computed structural properties
- XLogP
- -0.3
- Topological polar surface area
- 72.8 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 9
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 203
Experimental & physicochemical properties
SolubilitySoluble (NTP, 1992)
Physical DescriptionCytoxal alcohol is a colorless powder. (NTP, 1992)
Physicochemical properties
- FDA UNII
- 6 TG30F4XMK · 6TG30F4XMK
- EPA Substance Registry System
- Phosphorodiamidic acid, N,N-bis(2-chloroethyl)-N'-(3-hydroxypropyl)- (14504-75-7)
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
Reactive GroupAlcohols and Polyols
Air and Water ReactionsWater soluble.
Safety & protection
First Aid
EYES: First check the victim for contact lenses and remove if present. Flush victim's eyes with water or normal saline solution for 20 to 30 minutes while simultaneously calling a hospital or poison control center. Do not put any ointments, oils, or medication in the victim's eyes without specific instructions from a physician. IMMEDIATELY transport the victim after flushing eyes to a hospital even if no symptoms (such as redness or irritation) develop.
Personal Protective Equipment (PPE)
RECOMMENDED RESPIRATOR: Where the neat test chemical is weighed and diluted, wear a NIOSH-approved half face respirator equipped with a combination filter cartridge, i.e. organic vapor/acid gas/HEPA (specific for organic vapors, HCl, acid gas, SO2 and a high efficiency particulate filter). (NTP, 1992)
Chemistry & industry
Applications
General DescriptionColorless powder.
Suppliers11 total
湖北瑞玛标物科技有限公司15787879035 15787875101 · [email protected]
深圳睿迅光电材料科技有限公司0755-26718755; 15889762949 · [email protected]
河南阿尔法化工有限公司0371-55013243 15324716602 · [email protected]
上海鑫科泰生物科技有限公司18043446684 · [email protected]
上海昂提生物科技有限公司13764913901 · [email protected]
上海超岚化工科技中心（原上海巢莱）0-2022843681 15618226720 · [email protected]
湖北瑞诺医药科技有限公司13165688766 · [email protected]
北京爱科姆科技有限公司17710328343 · [email protected]
上海腾骞生物科技有限公司021-50895067 18616507272;13681616114;15020344067 · [email protected]
河南伊诺凯新材料有限公司18836288690 18836288690 · [email protected]
康迈迪森（北京）医药科技有限公司1851900025 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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