5,7-Difluoro-3-iodo-1-(phenylsulfonyl)-1H-indole

HCID 22014784CAS 500139-01-5

Basic information

Standard SMILES
O=S(=O)(c1ccccc1)n1cc(I)c2cc(F)cc(F)c21
InChIKey
MAJBTMPMUUCYME-UHFFFAOYSA-N
Molecular formula
C14H8F2INO2S
Average molar mass
419.19 g/mol
Monoisotopic mass
418.92885394

Names & identifiers

Preferred name
5,7-Difluoro-3-iodo-1-(phenylsulfonyl)-1H-indole
IUPAC
1-(benzenesulfonyl)-5,7-difluoro-3-iodoindole
English name
1H-Indole, 5,7-difluoro-3-iodo-1-(phenylsulfonyl)-
Molecular formula
C14H8F2INO2S
Molecular weight
419.19

Names & synonyms

5,7-Difluoro-3-iodo-1-(phenylsulfonyl)-1H-indole500139-01-51-(BENZENESULFONYL)-5,7-DIFLUORO-3-IODOINDOLE1H-Indole, 5,7-difluoro-3-iodo-1-(phenylsulfonyl)-1-(Benzenesulfonyl)-5,7-difluoro-3-iodo-1H-indoleMFCD13177483SCHEMBL5643286DTXSID90621501MAJBTMPMUUCYME-UHFFFAOYSA-NAVA13901DB-349752n-benzenesulfonyl-3-iodo-5,7-difluoroindole
Show more names
N-benzenesulfonyl-3-iodo-5,7-difluoro-indoleEN300-202397F18133

Database identifiers

CAS
500139-01-5
PubChem CID
22014784
DTXSID
DTXSID90621501

Properties

Computed structural properties

XLogP
4.1
Topological polar surface area
47.5 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
2
Heavy atoms
21

Physicochemical properties

storage temp.
2 · 2-8°C(protect from light)
HS Code
2933998090 · 2933998090

Safety & regulation

Safety data

hs_code
2933998090

Chemistry & industry

Suppliers8 total

上海安米克化学品有限公司微信 17321281695 18019252918 · [email protected]
常州合晶化工有限公司85528066 13775048983 · [email protected]
德州博腾精细化工有限公司[email protected]
华诺医药科技(广西)有限公司13005928603 · [email protected]
ATK CHEMICAL COMPANY LIMITED+undefined-21-51877795 · [email protected]

Related reactions

5 records

Linked notes

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