5,5-Dimethyl-8-nitro-1,3,4,5-tetrahydro-2H-benzo[b]azepin-2-one

Name: 5,5-Dimethyl-8-nitro-1,3,4,5-tetrahydro-2H-benzo[b]azepin-2-one
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CAS No. 1022972-64-0
Cat. No. CS-1055028
Molecule weight234.25
Purity≥97%
MDL No.None

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5,5-Dimethyl-8-nitro-1,3,4,5-tetrahydro-2H-benzo[b]azepin-2-one|CS-1055028

Structure of 1022972-64-0

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General Information

CAS No. 1022972-64-0
Cat. No. CS-1055028
Purity ≥97%
MDL No. None
Storage Sealed in dry,2-8℃
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₁₂H₁₄N₂O₃
Molecular Weight 234.25
Synonym(s) None
SMILES O=C1NC2=CC(=CC=C2C(C)(C)CC1)N(=O)=O

Safety Information

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GHS Pictogram : N/A	GHS No : N/A
Signal Word : N/A	UN#: N/A
Class : N/A	Packing Group : N/A
Hazard Statements : N/A
Precautionary Statements : N/A

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Computational Chemistry Data

TPSA 72.24
LogP 2.6047
H_Acceptors 3
H_Donors 1
Rotatable_Bonds 1

Other Classifications

Building Blocks Functional Group Nitro compounds

Building Blocks Skeleton Aromatic heterocycle compounds Other aromatic heterocycles compounds

Key Words

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5,5-Dimethyl-8-nitro-1,3,4,5-tetrahydro-2H-benzo[b]azepin-2-one

CAS No. 1022972-64-0

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