2-Amino-2,3-dihydroinden-1-one hydrochloride - CAS 6941-16-8

Catalog:	BB075008
Product Name:	2-Amino-2,3-dihydroinden-1-one hydrochloride
CAS:	6941-16-8
Synonyms:	2-Amino-2,3-dihydro-1H-inden-1-one hydrochloride; 2-AMINO-1-INDANONE HCL; 2-amino-2,3-dihydroinden-1-one; hydrochloride; 2-AMINO-2,3-DIHYDROINDEN-1-ONE HYDROCHLORIDE; amino-indanone hydrochloride; 2-Amino-2,3-dihydro-1H-inden-1-onehydrochloride

Technical Data

Safety and Hazards

Computed Properties

IUPAC Name:	2-amino-2,3-dihydroinden-1-onehydrochloride
Description:	2-Amino-2,3-dihydroinden-1-one hydrochloride
Molecular Weight:	183.64
Molecular Formula:	C9H10ClNO
Canonical SMILES:	C1C(C(=O)C2=CC=CC=C21)N.Cl
InChI:	InChI=1S/C9H9NO.ClH/c10-8-5-6-3-1-2-4-7(6)9(8)11/h1-4,8H,5,10H21H
InChI Key:	AORFTSYQWUGEFL-UHFFFAOYSA-N

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GHS Hazard Statement:	H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	178
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	2
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	183.0450916
Formal Charge:	0
Heavy Atom Count:	12
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	183.0450916
Rotatable Bond Count:	0
Topological Polar Surface Area:	43.1Å²
Undefined Atom Stereocenter Count:	1
Undefined Bond Stereocenter Count:	0