6-Bromo-5-chloroindoline

CAT: 0127-OR1065718-01Size: 100 mgDry Ice: NoHazardous: No

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CAT#:0127-OR1065718-01Size:100 mg

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CAS Number

1369237-21-7

MDL Number

MFCD22035169

Purity

96%

Smiles

ClC1=CC2=C(NCC2)C=C1Br

Chemical Information

6-Bromo-5-chloro-2,3-dihydro-1H-indole

CAS Number	1369237-21-7
PubChem CID	82390224
IUPAC Name	6-bromo-5-chloro-2,3-dihydro-1H-indole
Molecular Formula	C8H7BrClN
Molecular Weight	232.50
XLogP	3.3
Topological Polar Surface Area	12
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	0
Heavy Atom Count	11
Formal Charge	0
Complexity	153

SMILES

C1CNC2=CC(=C(C=C21)Cl)Br

InChI

InChI=1S/C8H7BrClN/c9-6-4-8-5(1-2-11-8)3-7(6)10/h3-4,11H,1-2H2

InChIKey

BZARUHDUTAVPPR-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 1369237-21-7

CID: 82390224

Formula: C8H7BrClN

MW: 232.50

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	232.50
XLogP3	3.3
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	0
Exact Mass	230.94504
Monoisotopic Mass	230.94504
Topological Polar Surface Area	12 Å²
Heavy Atom Count	11
Formal Charge	0
Complexity	153
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
OR1059712-01	5-Bromo-7-chloroindoline
OR5335-01	5-Chloroindoline
OR1064295-01	5-Bromo-7-chloroindoline-2,3-dione
OR1046140-01	7-Chloroindoline
OR61177-01	4-Chloroindoline
OR1045397-01	5-Chloroindoline-2-carboxylic acid
OR76504-01	6-Bromo-4-chlorocinnoline
OR1085813	5-bromo-6-chloropicolinamide
OR1031320-01	5-Bromo-6-methylnicotinaldehyde
OR1065615-01	6-Bromo-5-chloronicotinonitrile

Catalog	Name
sc-284611	5-Chloroindoline
NZA65697	5-Bromo-7-chloroindoline-2,3-dione
MMA59029-01	7-Bromo-5-chloroindoline-2,3-dione
sc-237459	1-Acetyl-6-chloroindoline
sc-460493	4-Chloroindoline
PEA14422-01	7-Chloroindoline
BAC02348	4-Chloroindoline hydrochloride
QCA87373-01	5-Bromo-6-methoxynicotinaldehyde
GAC82365	5-Bromo-6-chloropicolinonitrile
435767-01	5-Bromo-6-methoxybenzoimidazole