10-carbazol-9-ylanthracene-9-carbaldehyde

C27H17NO — CID 134598541

IUPAC10-carbazol-9-ylanthracene-9-carbaldehyde
SMILESO=Cc1c2ccccc2c(-n2c3ccccc3c3ccccc32)c2ccccc12
InChIInChI=1S/C27H17NO/c29-17-24-18-9-1-3-13-22(18)27(23-14-4-2-10-19(23)24)28-25-15-7-5-11-20(25)21-12-6-8-16-26(21)28/h1-17H
InChIKeyATTYJENLOQXLSZ-UHFFFAOYSA-N
MW371.44 g/mol
LogP6.90
Rot. Bonds2

About 10-carbazol-9-ylanthracene-9-carbaldehyde

10-carbazol-9-ylanthracene-9-carbaldehyde (PubChem CID 134598541) has the molecular formula C27H17NO and a molecular weight of 371.44 g/mol. Its IUPAC name is 10-carbazol-9-ylanthracene-9-carbaldehyde.

Molecular Properties

Compound Name10-carbazol-9-ylanthracene-9-carbaldehyde
PubChem CID134598541
Molecular FormulaC27H17NO
Molecular Weight371.44 g/mol
Exact Mass371.13
IUPAC Name10-carbazol-9-ylanthracene-9-carbaldehyde
SMILESO=Cc1c2ccccc2c(-n2c3ccccc3c3ccccc32)c2ccccc12
InChIInChI=1S/C27H17NO/c29-17-24-18-9-1-3-13-22(18)27(23-14-4-2-10-19(23)24)28-25-15-7-5-11-20(25)21-12-6-8-16-26(21)28/h1-17H
InChIKeyATTYJENLOQXLSZ-UHFFFAOYSA-N
XLogP6.90
TPSA22.00 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500371.44
LogP ≤ 56.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}

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Related Compounds

anthracene-9,10-dicarbaldehyde;dihydrochloride
CID 19762841
9-(10-carbazol-9-yl-2,3-diethylanthracen-9-yl)carbazole
CID 143467653
19-[10-(19-azapentacyclo[14.2.1.05,18.06,11.012,17]nonadeca-1,3,5(18),6,8,10,12(17),13,15-nonaen-19-yl)anthracen-9-yl]-19-azapentacyclo[14.2.1.05,18.06,11.012,17]nonadeca-1,3,5(18),6,8,10,12(17),13,15-nonaene
CID 88951403
9-[2,3,4,5-tetra(carbazol-9-yl)-6-methylphenyl]carbazole
CID 147406745
9-[4,7-di(carbazol-9-yl)benzo[a]anthracen-12-yl]carbazole
CID 59412616
2-carbazol-9-ylbenzene-1,3-diamine
CID 122584908
3-formyl-2-oxo-1-phenylquinolin-4-olate
CID 51371497
9-phenyl-14-[10-(14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-9-yl)anthracen-9-yl]-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene
CID 170394033
1-(4-hydroxyphenyl)-2-methylindole-3-carbaldehyde
CID 87772568
9-(10-phenylanthracen-9-yl)-3-[9-(10-phenylanthracen-9-yl)carbazol-3-yl]carbazole
CID 168729209
4-[3-(3-carbazol-9-ylcarbazol-9-yl)carbazol-9-yl]benzaldehyde
CID 24814953
2-methyl-1-(2,2,2-trifluoroacetyl)indole-3-carbaldehyde
CID 91690166

Frequently Asked Questions

What is the IUPAC name of 10-carbazol-9-ylanthracene-9-carbaldehyde?
The IUPAC name of 10-carbazol-9-ylanthracene-9-carbaldehyde (CID 134598541) is 10-carbazol-9-ylanthracene-9-carbaldehyde.
What is the SMILES notation for 10-carbazol-9-ylanthracene-9-carbaldehyde?
The canonical SMILES for 10-carbazol-9-ylanthracene-9-carbaldehyde is O=Cc1c2ccccc2c(-n2c3ccccc3c3ccccc32)c2ccccc12.
What is the InChIKey of 10-carbazol-9-ylanthracene-9-carbaldehyde?
The InChIKey is ATTYJENLOQXLSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H17NO/c29-17-24-18-9-1-3-13-22(18)27(23-14-4-2-10-19(23)24)28-25-15-7-5-11-20(25)21-12-6-8-16-26(21)28/h1-17H.
What are the key properties of 10-carbazol-9-ylanthracene-9-carbaldehyde?
10-carbazol-9-ylanthracene-9-carbaldehyde has a molecular weight of 371.44 g/mol, XLogP of 6.90, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 10-carbazol-9-ylanthracene-9-carbaldehyde is sourced from PubChem (CID 134598541), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).