Basic information
- CAS
60106-92-5- Standard SMILES
O=P(Cl)(N(CCCl)CCCl)N(CCCl)CCCl- InChIKey
QXUFUUCHZZBJNO-UHFFFAOYSA-N- Molecular formula
- C8H16Cl5N2OP
- Average molar mass
- 364.5 g/mol
- Monoisotopic mass
- 361.944289
Names & identifiers
- Preferred name
- N,N,N',N'-Tetrakis(2-chloroethyl)phosphorodiamidic Chloride
- IUPAC
- N-[bis(2-chloroethyl)amino-chlorophosphoryl]-2-chloro-N-(2-chloroethyl)ethanamine
- English name
- tetrakis(2-chloroethyl)phosphorodiamidic chloride
- Molecular formula
- C8H16Cl5N2OP
- Molecular weight
- 364.46
Names & synonyms
60106-92-5Tetrakis(2-chloroethyl)phosphorodiamidic ChlorideN,N,N',N'-Tetrakis(2-chloroethyl)phosphorodiamidic ChlorideN-[bis(2-chloroethyl)amino-chlorophosphoryl]-2-chloro-N-(2-chloroethyl)ethanamineNSC-236636Phosphorodiamidic chloride, tetrakis(2-chloroethyl)-Phosphorodiamidic chloride, N,N,N',N'-tetrakis(2-chloroethyl)-NSC236636W8W7VU5H2KCyclophosphamide Impurity 53SCHEMBL314234DTXSID10330264
Show more names
NSC 236636Phoxim Impurity 3CyclophosphaMide IMpurity B
QXUFUUCHZZBJNO-UHFFFAOYSA-NKCA10692DB-234036H55683N,N,N',N'-Tetrakis(2-chloroethyl)phosphorodiamidoyl chloride
Database identifiers
- CAS
60106-92-5- PubChem CID
- 428391
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 23.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 10
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 214
Physicochemical properties
- Melting point
- 48 · 48-49 °C
- Boiling point
- 419.9 · 419.9±55.0 °C(Predicted)
- Density
- 1.422 · 1.422±0.06 g/cm3(Predicted)
- pka
- -4.77 · -4.77±0.70(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
- RIDADR
- 1759 · 1759
- HazardClass
- 8 · 8
- PackingGroup
- II
Safety & regulation
Safety data
- ridadr
- 1759
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_class
- 8
- packing_group
- II
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Applications
UsesAn impurity of Cyclophosphamide (C988580).
Upstream & downstream products
Upstream raw materials
Suppliers10 total
江苏艾康生物医药研发有限公司025-66061636 19370895928 · [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]
湖北扬信医药科技有限公司15347293736 · [email protected]
BOC Sciences16314854226; +8616314854226 · [email protected]
BOC Sciences16314854226 · [email protected]
上海源叶生物科技有限公司13636370518 · [email protected]
山东弗珍化学科技有限公司13146841504 · [email protected]
深圳聚合生化科技有限公司+86-400-002-6226 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
Related reactions
10 records
Compound notes
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