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101861-63-6,MFCD00209870
Catalog No.:AA0005PT
101861-63-6 | 4,6-Dichloro-1h-indole-2-carboxylic acid
Pack Size
Purity
Availability
Price(USD)
Quantity
  
100mg
95%
in stock  
$36.00   $25.00
- +
250mg
95%
in stock  
$64.00   $45.00
- +
1g
96%
in stock  
$100.00   $70.00
- +
5g
96%
in stock  
$429.00   $300.00
- +
10g
96%
in stock  
$746.00   $522.00
- +
25g
96%
in stock  
$1,460.00   $1,022.00
- +
  • Technical Information
  • Properties
  • Literature
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  • Q & A
  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA0005PT
Chemical Name:
4,6-Dichloro-1h-indole-2-carboxylic acid
CAS Number:
101861-63-6
Molecular Formula:
C9H5Cl2NO2
Molecular Weight:
230.0475
MDL Number:
MFCD00209870
IUPAC Name:
4,6-dichloro-1H-indole-2-carboxylic acid
InChI:
InChI=1S/C9H5Cl2NO2/c10-4-1-6(11)5-3-8(9(13)14)12-7(5)2-4/h1-3,12H,(H,13,14)
InChI Key:
DHXISZKSSIWRLH-UHFFFAOYSA-N
SMILES:
Clc1cc(Cl)c2c(c1)[nH]c(c2)C(=O)O
Properties
Computed Properties
 
Complexity:
249  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
228.97g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
230.044g/mol
Monoisotopic Mass:
228.97g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
53.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2  

Synonyms
 
2-carboxy-4,6-dichloro-(1H)-indole-3-propanoic acid 
3-(4,6-dichloro-2-carboxyindol-3-yl)propionic acid 
1H-Indole-2-carboxylicacid, 4,6-dichloro- 
3-(4,6-Dichloro-2-carboxyindol-3-yl)propionic acid 
3-Dccip 
KBio2_007460 
PubChem7197 
Spectrum_001822 
4,6-Dichloro-1H-indole-2-carboxylicacid 
ACMC-1BPUR 
SpecPlus_000800 
AC1L2SZE 
3-DCCIP 
AC1Q3MQM 
Maybridge1_006804 
AC1Q73TA 
Oprea1_268024 
KBioSS_002327 
DivK1c_006896 
SCHEMBL727389 
CTK0H4782 
HMS560N06 
KBio1_001840 
MDL 29951 
KBio2_002324 
KBio2_004892 
DTXSID80144299 
DHXISZKSSIWRLH-UHFFFAOYSA-N 
KS-00000D0V 
ZINC2557959 
4,6-Dichloroindole-2-carboxylicAcid 
ANW-60044 
BBL020540 
BDBM50004960 
MDL-29951 
MFCD00209870 
SBB063804 
STK893229 
AKOS001476065 
4,6-dichloro-indole-2-carboxylic acid 
AC-9000 
AN-7441 
CS-W022054 
MCULE-9834255003 
MP-0302 
MDL29,951 
QC-9710 
RTC-061117 
SB14718 
VI30211 
AJ-40081 
AK-23720 
AS-14979 
N453 
SC-00094 
SY040441 
101861-63-6 
Indole-2-carboxylic acid, 4,6-dichloro- 
AB0015796 
DB-014408 
ST2417911 
TC-061117 
4CH-015032 
BB 0248940 
FT-0630299 
1H-Indole-2-carboxylic acid, 4,6-dichloro- 
EN300-85654 
4,6-dichloro-1H-indole-2-carboxylic acid 
MFCD00209870 (95%) 
4,6-dichloroindole-2-carboxylic acid, AldrichCPR 
861D636 
I01-2951 
Q-101954 
Z228589232 
C9H5Cl2NO2 
Mdl-29951 
D00YYW 
D03GBO 
4,6-Dichloroindole-2-carboxylic acid 
C9-H5-Cl2-N-O2 
Mdl 29951 
AR-1F8616 
CD-564 
CID127988 
A16296 
4,6-Dichloro-1H-indole-2-carboxylic acid, 97% 1g 
189333-48-0 
86-98-6 
CHEMBL301556 
Literature

Title: 3-(2-carboxyethyl)-4,6-dichloro-1H-indole-2-carboxylic acid: an allosteric inhibitor of fructose-1,6-bisphosphatase at the AMP site.

Journal: Bioorganic & medicinal chemistry letters 20030616

Title: Hydantoin-substituted 4,6-dichloroindole-2-carboxylic acids as ligands with high affinity for the glycine binding site of the NMDA receptor.

Journal: Journal of medicinal chemistry 20030102

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