10-Anthracenecarboxamide, 9,10-dihydro-9,9-dimethyl-

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Basic information

CAS: 66827-79-0
Standard SMILES: CC1(C)c2ccccc2C(C(N)=O)c2ccccc21
InChIKey: UWMZNKWXDLPJBY-UHFFFAOYSA-N
Molecular formula: C17H17NO
Average molar mass: 251.32 g/mol
Monoisotopic mass: 251.13101417

Names & identifiers

Preferred name: 10-Anthracenecarboxamide, 9,10-dihydro-9,9-dimethyl-
IUPAC: 10,10-dimethyl-9H-anthracene-9-carboxamide

Names & synonyms

BRN 258709010-ANTHRACENECARBOXAMIDE, 9,10-DIHYDRO-9,9-DIMETHYL-9,9-Dimethyl-9,10-dihydro-10-anthracenecarboxamide66827-79-0DTXSID30216950RefChem:235666DTXCID6013944110,10-dimethyl-9,10-dihydroanthracene-9-carboxamideSCHEMBL6867151UWMZNKWXDLPJBY-UHFFFAOYSA-N

Database identifiers

CAS: 66827-79-0
PubChem CID: 48114
DTXSID: DTXSID30216950

Properties

Computed structural properties

XLogP: 3.3
Topological polar surface area: 43.1 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 1
Rotatable bonds: 1
Heavy atoms: 19
Formal charge: 0
Complexity: 336

Related reactions

2 records

New reaction record

HRID 163294As reactantTraining data from https://doi.org/10.1039/C8SC04228D (9/10)

HRID 393253As reactantuspto-grants-2004_10

Compound notes

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