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CAS No.: | 67292-62-0 |
---|---|
Name: | 4-HYDROXYCYCLOPHOSPHAMIDE |
Molecular Structure: | |
Formula: | C7H15Cl2N2O3P |
Molecular Weight: | 277.11 |
Synonyms: | 4-OH-CP; |
Boiling Point: | 351.4°C at 760 mmHg |
Flash Point: | 166.3°C |
Safety: | Poison by intravenous and intraperitoneal routes. Human mutation data reported. When heated to decomposition it emits very toxic fumes of Cl−, POx, and NOx. |
PSA: | 58.32000 |
LogP: | 1.65000 |
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Molecular Formula: C7H15Cl2N2O2P
Molar mass: 261.085961 g/mol
Flash Point: 166.3 °C
Boiling Point: 351.4 °C at 760 mmHg
Vapour Pressure: 2.43E-06 mmHg at 25°C
Structure of 4-Hydroxycyclophosphamide (67292-62-0):
XLogP3-AA: 0.8
H-Bond Donor: 2
H-Bond Acceptor: 4
Systematic Name of 4-Hydroxycyclophosphamide (67292-62-0): 2-Bis(2-chloroethyl)amino]-1,3,2-oxazaphosphinan-4-ol
SMILES: ClCCN(P1OCCC(O)N1)CCCl
InChI: InChI=1/C7H15Cl2N2O2P/c8-2-4-11(5-3-9)14-10-7(12)1-6-13-14/h7,10,12H,1-6H2
InChIKey: UGYXAZPJFUKXSM-UHFFFAOYAV
Std. InChI: InChI=1S/C7H15Cl2N2O2P/c8-2-4-11(5-3-9)14-10-7(12)1-6-13-14/h7,10,12H,1-6H2
Std. InChIKey: UGYXAZPJFUKXSM-UHFFFAOYSA-N
1. | mmo-sat 10 µg/plate | CNREA8 Cancer Research. 42 (1982),3016. | ||
2. | mma-sat 10 µg/plate | CNREA8 Cancer Research. 42 (1982),3016. | ||
3. | sce-hmn:lym 1 µmol/L | MUREAV Mutation Research. 129 (1984),47. | ||
4. | dnd-mus:leu 50 µmol/L | CNREA8 Cancer Research. 44 (1984),5156. | ||
5. | ivn-rat LD50:139 mg/kg | JMCMAR Journal of Medicinal Chemistry. 18 (1975),376. | ||
6. | ipr-mus LD50:141 mg/kg | INNDDK Investigational New Drugs. The Journal of New Anticancer Agents. 2 (1984),253. |
Poison by intravenous and intraperitoneal routes. Human mutation data reported. When heated to decomposition it emits very toxic fumes of Cl−, POx, and NOx.
4-Hydroxycyclophosphamide (67292-62-0) also can be called 2H-1,3,2-Oxazaphosphorine, 2-(bis(2-chloroethyl)amino)-4-hydroxytetrahydro-, 2-oxide ; 4-OH-CP ;and ; 2-(Bis(2-chloroethyl)amino)-4-hydroxytetrahydro-2H-1,3,2-oxazaphosphorine .