949898-66-2
AS-136A
Name
AS-136A
pro_formula
C17 H19 F3 N4 O3 S
pro_molWeight
416.422
1Identification
【Name】
AS-136A
【CAS】
【MDL】
MFCD16875415
【中文同义词】
【EnglishSynonyms】
【pro_formula】
C17 H19 F3 N4 O3 S
【pro_molWeight】
416.422
【Inchi】
InChI=1S/C17H19F3N4O3S/c1-23-14(11-15(22-23)17(18,19)20)16(25)21-12-5-7-13(8-6-12)28(26,27)24-9-3-2-4-10-24/h5-8,11H,2-4,9-10H2,1H3,(H,21,25)
【InChIKey】
InChIKey=OJDLQNVQEAZKSL-UHFFFAOYSA-N
【SMILES】
Cn1c(cc(n1)C(F)(F)F)C(=O)Nc2ccc(cc2)S(=O)(=O)N3CCCCC3
【MOL File】
2ChemicalProperties
【ComputedProperties】
pro_donors:1
pro_acceptors:7
XLogP3:4.0
Bulk/Fine:F
3MaterialMSDS
【secure_infosecure_symbol】
【secure_signal_word】
【secure_risk_stmt】
【secure_cautionary_stmt】
【secure_damage_code】
【secure_risk_disclosure_stmt】
【secure_security_stmt】
【secure_wgk_germany】
3
4CMLFile
AS-136A.cml
quick_release
3-(DIFLUOROMETHYL)-4-FORMYL-1-METHYL-1H-PYRAZOLE
1094484-55-5 ;1094484-55-5
3-(TERT-BUTYL)-1-ETHYL-1H-PYRAZOLE-5-CARBOXYLIC ACID
195447-83-7
3-CHLORO-5,5-DIMETHYL-IMIDAZOLIDINE-2,4-DIONE
34979-51-6
ETHYL 5-AMINO-1-TERT-BUTYL-1H-PYRAZOLE-3-CARBOXYLATE
866838-01-9
ETHYL 3,5-DIOXOPYRAZOLIDINE-1-CARBOXYLATE
98135-17-2
MTH-DL-LEUCINE
1076-72-8
SuppliersList
Relatedproducts
3-(DIFLUOROMETHYL)-4-FORMYL-1-METHYL-1H-PYRAZOLE
1094484-55-5 ;1094484-55-5
3-(TERT-BUTYL)-1-ETHYL-1H-PYRAZOLE-5-CARBOXYLIC ACID
195447-83-7
3-CHLORO-5,5-DIMETHYL-IMIDAZOLIDINE-2,4-DIONE
34979-51-6
ETHYL 5-AMINO-1-TERT-BUTYL-1H-PYRAZOLE-3-CARBOXYLATE
866838-01-9
ETHYL 3,5-DIOXOPYRAZOLIDINE-1-CARBOXYLATE
98135-17-2
MTH-DL-LEUCINE
1076-72-8