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2-Amino-2,4,6-cycloheptatrien-1-one

2-Amino-2,4,6-cycloheptatrien-1-one structure

CAS No:
6264-93-3
Formula:
C7H7NO
Chemical Name:
2-Amino-2,4,6-cycloheptatrien-1-one
Synonyms:
2,4,6-Cycloheptatrien-1-one,2-amino-;2-Amino-2,4,6-cycloheptatrien-1-one;2-Aminotropone

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2-Amino-2,4,6-cycloheptatrien-1-one Basic Attributes

Molecular Weight：

121.13658

Exact Mass：

121.14

Characteristics

PSA：

43.1

XLogP3：

-0.01

Density：

1.1±0.1 g/cm3

Melting Point：

100-101 °C (sublm) @ Solvent: Acetonitrile

Boiling Point：

276.2±20.0 °C at 760 mmHg

Flash Point：

120.8±21.8 °C

Refractive Index：

1.569

Toxicity：

Peritoneal-mouse LD50: 176 mg/kg; subcutaneous-mouse LD50: 175 mg/kg

Flammability characteristics：

Flammable; burning produces toxic nitrogen oxide fumes

Safety Information

Storage features：

Warehouse ventilated, low temperature and dry

Toxicity

Toxicity class：

highly toxic

Drug Information

MeSH Entry Terms：

2-aminotropone

Computed Properties

Molecular Weight:121.14
XLogP3:0.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Exact Mass:121.052763847
Monoisotopic Mass:121.052763847
Topological Polar Surface Area:43.1
Heavy Atom Count:9
Complexity:211
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-Amino-2,4,6-cycloheptatrien-1-one

Basic Attributes
Characteristics
Safety Information
Toxicity
Drug Information
Computed Properties

2-Amino-2,4,6-cycloheptatrien-1-one

SDS

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