6-Chloro-2,3-dihydro-1h-indole

HCID 258567
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Basic information

CAS
52537-00-5
Standard SMILES
Clc1ccc2c(c1)NCC2
InChIKey
HSLNYVREDLDESE-UHFFFAOYSA-N
Molecular formula
C8H8ClN
Average molar mass
153.61 g/mol
Monoisotopic mass
153.03452694

Names & identifiers

Preferred name
6-Chloro-2,3-dihydro-1h-indole
IUPAC
6-chloro-2,3-dihydro-1H-indole
English name
6-Chloro-2,3-dihydro-1H-indole
Molecular formula
C8H8ClN
Molecular weight
153.61

Names & synonyms

6-chloro-2,3-dihydro-1h-indole52537-00-56-ChloroindolineMFCD073716391H-Indole, 6-chloro-2,3-dihydro-6-chloro-indolineNSC876286-chloro-2,3-dihydroindoleSCHEMBL549646SCHEMBL886767SCHEMBL1090905SCHEMBL29924038
Show more names
NSC 876281H-INDOLE,6-CHLORO-2,3-DIHYDRO-
DTXSID20293174HSLNYVREDLDESE-UHFFFAOYSA-NNSC-87628AKOS006229895SB37510DS-14155SY019160DB-071542

Database identifiers

CAS
52537-00-5
PubChem CID
258567
DTXSID
DTXSID20293174
EC Number
884-630-9

Properties

Computed structural properties

XLogP
2.7
Topological polar surface area
12 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
1
Rotatable bonds
0
Heavy atoms
10

Physicochemical properties

Boiling point
250.3 · 250.3±29.0 °C(Predicted)
Density
1.214 · 1.214±0.06 g/cm3(Predicted)
storage temp.
2 · under inert gas (nitrogen or Argon) at 2–8 °C
pka
4.32 · 4.32±0.20(Predicted)
Appearance
Off-white to gray Solid
Symbol(GHS)
7 · GHS07

Safety & regulation

Safety data

Signal word
Warning
Symbol(GHS)
GHS07
Hazard statements
H302-H317
Precautionary statements
P280

Chemistry & industry

Upstream & downstream products

Upstream raw materials

Suppliers72 total

上海艾澜医药有限公司021-58099609-8008 13816260319 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]
Sichuan Biosynce Pharmatech Co., Ltd.[email protected]
Suzhou ARTK Medchem Co., Ltd.+86-18168183658 · [email protected]

Related reactions

58 records
New reaction record

Compound notes

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