CAS
903549-49-5 Purity
96%
903549-49-5 Purity
96%
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1H-Indole,4,6-dichloro-2,3-dihydro-
CAS
903551-23-5
Catalog Number
ACM903551235
Category
Other Products
Molecular Weight
224.51482
Molecular Formula
C8H7 Cl2 N
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Specification
Synonyms
AmbagaB35369, 4,6-dichloroindoline hydrochloride, EN000955, 903551-23-5
IUPAC Name
4,6-dichloro-2,3-dihydro-1H-indole hydrochloride
Canonical SMILES
C1CNC2=CC(=CC(=C21)Cl)Cl.Cl
InChI Key
RREOOKIQVLLQMO-UHFFFAOYSA-N
Exact Mass
222.97200
H-Bond Acceptor
1
H-Bond Donor
2
What is the molecular formula of the compound?
The molecular formula of the compound is C8H8Cl3N.
What is the molecular weight of the compound?
The molecular weight of the compound is 224.5 g/mol.
What is the IUPAC name of the compound?
The IUPAC name of the compound is 4,6-dichloro-2,3-dihydro-1H-indole;hydrochloride.
What is the InChI of the compound?
The InChI of the compound is InChI=1S/C8H7Cl2N.ClH/c9-5-3-7(10)6-1-2-11-8(6)4-5;/h3-4,11H,1-2H2;1H.
What is the InChIKey of the compound?
The InChIKey of the compound is RREOOKIQVLLQMO-UHFFFAOYSA-N.
What is the canonical SMILES of the compound?
The canonical SMILES of the compound is C1CNC2=C1C(=CC(=C2)Cl)Cl.Cl.
What is the CAS number of the compound?
The CAS number of the compound is 903551-23-5.
What is the hydrogen bond donor count of the compound?
The hydrogen bond donor count of the compound is 2.
What is the hydrogen bond acceptor count of the compound?
The hydrogen bond acceptor count of the compound is 1.
Is the compound canonicalized?
Yes, the compound is canonicalized.
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