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1-(4-Chlorobenzoyl)-5-methoxy-2-methyl-1H-indole-3-acetyl chloride

HCID 88506
NotesReactions
Basic informationNames & identifiersPropertiesChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
20357-37-3
Standard SMILES
COc1ccc2c(c1)c(CC(=O)Cl)c(C)n2C(=O)c1ccc(Cl)cc1
InChIKey
VCVWWGAKIXAYTN-UHFFFAOYSA-N
Molecular formula
C19H15Cl2NO3
Average molar mass
376.2 g/mol
Monoisotopic mass
375.0428987

Names & identifiers

Preferred name
1-(4-Chlorobenzoyl)-5-methoxy-2-methyl-1H-indole-3-acetyl chloride
IUPAC
2-[1-(4-chlorobenzoyl)-5-methoxy-2-methylindol-3-yl]acetyl chloride
English name
1-(4-chlorobenzoyl)-5-methoxy-2-methyl-1H-indole-3-acetyl chloride
Molecular formula
C19H15Cl2NO3
Molecular weight
376.23

Names & synonyms

20357-37-31-(4-Chlorobenzoyl)-5-methoxy-2-methyl-1H-indole-3-acetyl chlorideEINECS 243-763-7RefChem:74439243-763-72-[1-(4-chlorobenzoyl)-5-methoxy-2-methylindol-3-yl]acetyl chloride2-(1-(4-chlorobenzoyl)-5-methoxy-2-methyl-1H-indol-3-yl)acetyl chlorideSCHEMBL3813031SCHEMBL31211688DTXSID80942515DA-08444NS00050933
Show more names
1H-Indole-3-acetyl chloride, 1-(4-chlorobenzoyl)-5-methoxy-2-methyl-1-(4-Chlorobenzoyl)-2-methyl-5-methoxy-1H-indole-3-acetic acid chloride
1-(p-chlorobenzoyl)-5-methoxy-2-methyl-3-indolylacetylchloride[1-(4-Chlorobenzoyl)-5-methoxy-2-methyl-1H-indol-3-yl]acetyl chloride

Database identifiers

CAS
20357-37-3
PubChem CID
88506
DTXSID
DTXSID80942515

Properties

Computed structural properties

XLogP
5.3
Topological polar surface area
48.3 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
4
Heavy atoms
25
Formal charge
0
Complexity
507

Chemistry & industry

Suppliers2 total

HONEST JOY HOLDINGS LIMITED[email protected]
德拜科技有限公司00852-2521 1836

Related reactions

1 records
New reaction record
HRID 189496 reaction equation
HRID 189496As reactantTraining data from https://doi.org/10.1039/C8SC04228D (6/10)

Compound notes

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On this pageBasic informationNames & identifiersPropertiesChemistry & industryRelated reactionsCompound notes
EC Number
243-763-7
Nikkaji
J280.572C