| CAS Number | 61903-30-8 |
| Catalog Number | AG00EL1P(AGN-PC-0T274R) |
| Chemical Name | (R,S)-4-Hydroxy Cyclophosphamide Preparation Kit |
| IUPAC Name | (2R,4S)-2-[bis(2-chloroethyl)amino]-2-oxo-1,3,2λ5-oxazaphosphinan-4-ol |
| InChI | InChI=1S/C7H15Cl2N2O3P/c8-2-4-11(5-3-9)15(13)10-7(12)1-6-14-15/h7,12H,1-6H2,(H,10,13)/t7-,15+/m0/s1 |
| InChI Key | RANONBLIHMVXAJ-NZFNHWASSA-N |
| MDL Number | MFCD00869529 |
| Molecular Formula | C7H15Cl2N2O3P |
| Molecular Weight | 277.0854 |
| SMILES | OC1CCOP(=O)(N1)N(CCCl)CCCl |
| Synonyms | 61903-30-8,
DTXSID50857748,
ZINC897102,
(R,S)-4-Hydroxy Cyclophosphamide See: H926301,
(R,S)-4-Hydroxy Cyclophosphamide, Preparation Kit,
UNII-1XBF4E50HS component RANONBLIHMVXAJ-NZFNHWASSA-N,
(2R,4S)-2-[Bis(2-chloroethyl)amino]-4-hydroxy-1,3,2lambda~5~-oxazaphosphinan-2-one,
(2R,4S)-rel-2-[Bis(2-chloroethyl)amino]tetrahydro-2H-1,3,2-oxazaphosphorin-4-ol 2-Oxide,
(R,S)-4-Hydroxycyclophosphamide,
|
| Complexity | 238 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 2 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 276.02g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 277.082g/mol |
| Monoisotopic Mass | 276.02g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 61.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number