37752-44-6
1-PENTANESULFONIC ACID, 2-((3-(2-CHLOROETHYL)TETRAHYDRO-2H-1,3,2-OXAZA PHOSPHORIN-2-YL)AMINO)ETHYL ESTER, P-OXIDE
Name1-PENTANESULFONIC ACID, 2-((3-(2-CHLOROETHYL)TETRAHYDRO-2H-1,3,2-OXAZA PHOSPHORIN-2-YL)AMINO)ETHYL ESTER, P-OXIDE
FormulaC12 H26 Cl N2 O5 P S
1Identification
【Name】
1-PENTANESULFONIC ACID, 2-((3-(2-CHLOROETHYL)TETRAHYDRO-2H-1,3,2-OXAZA PHOSPHORIN-2-YL)AMINO)ETHYL ESTER, P-OXIDE
【CAS】
【MDL】
MFCD01709249
【English Synonyms】
【Formula】
C12 H26 Cl N2 O5 P S
【MolWeight】
376.839
【Inchi】
InChI=1S/C12H26ClN2O5PS/c1-2-3-4-12-22(17,18)20-11-7-14-21(16)15(9-6-13)8-5-10-19-21/h2-12H2,1H3,(H,14,16)
【InChIKey】
InChIKey=YUDPVYSCZFNMJQ-UHFFFAOYSA-N
【SMILES】
CCCCCS(=O)(=O)OCCNP1(=O)N(CCCO1)CCCl
【MOL File】
1-PENTANESULFONIC AC….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:7
XLogP3:1.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
1-PENTANESULFONIC ACID, 2-((3-(2-CHLOROETHYL)TETRAHYDRO-2H-1,3,2-OXAZA PHOSPHORIN-2-YL)AMINO)ETHYL ESTER, P-OXIDE.cml