955112-59-1
TERT-BUTYL (5-CHLORO-2-(METHYLSULFONYL)PYRIMIDIN-4-YL)CARBAMATE
NameTERT-BUTYL (5-CHLORO-2-(METHYLSULFONYL)PYRIMIDIN-4-YL)CARBAMATE
FormulaC10 H14 Cl N3 O4 S
1Identification
【Name】
TERT-BUTYL (5-CHLORO-2-(METHYLSULFONYL)PYRIMIDIN-4-YL)CARBAMATE
【CAS】
【MDL】
MFCD13195433
【English Synonyms】
【Formula】
C10 H14 Cl N3 O4 S
【MolWeight】
307.757
【Inchi】
InChI=1S/C10H14ClN3O4S/c1-10(2,3)18-9(15)14-7-6(11)5-12-8(13-7)19(4,16)17/h5H,1-4H3,(H,12,13,14,15)
【InChIKey】
InChIKey=BRQMVVSECBWDCA-UHFFFAOYSA-N
【SMILES】
CC(C)(C)OC(=O)Nc1c(cnc(n1)S(=O)(=O)C)Cl
【MOL File】
TERT-BUTYL (5-CHLORO….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:7
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
TERT-BUTYL (5-CHLORO-2-(METHYLSULFONYL)PYRIMIDIN-4-YL)CARBAMATE.cml