| Identification | Back Directory | [Name]
1,4,8,11-Tetrakis[(4-methylphenyl)sulfonyl]-1,4,8,11-tetraazacyclotetradecane | [CAS]
71089-74-2 | [Synonyms]
Plerixafor Impurity 42
1,4,8,11-tetratosyl-1,4,8,11-tetraazacyclotetradecane
1,4,8,11-tetrakis-(4-methylphenyl)sulfonyl-1,4,8,11-tetrazacyclotetradecane
1,4,8,11-Tetrakis[(4-methylphenyl)sulfonyl]-1,4,8,11-tetraazacyclotetradecane | [Molecular Formula]
C38H48N4O8S4 | [MDL Number]
MFCD00188459 | [MOL File]
71089-74-2.mol | [Molecular Weight]
817.07 |
| Chemical Properties | Back Directory | [Melting point ]
284-287 °C | [Boiling point ]
916.9±75.0 °C(Predicted) | [density ]
1.303 | [storage temp. ]
under inert gas (nitrogen or Argon) at 2-8°C | [pka]
-6.21±0.20(Predicted) | [InChIKey]
OVVMBINCTWKHOS-UHFFFAOYSA-N | [SMILES]
N1(S(C2=CC=C(C)C=C2)(=O)=O)CCCN(S(C2=CC=C(C)C=C2)(=O)=O)CCN(S(C2=CC=C(C)C=C2)(=O)=O)CCCN(S(C2=CC=C(C)C=C2)(=O)=O)CC1 |
|
|