Phenanthrenes and derivatives

Polycyclic aromatic hydrocarbon compounds that consist of fourteen carbon atoms and ten hydrogen atoms fused into three benzene rings. Includes compounds that are derived from phenanthrenes.

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31 – 45 of 257 results

Carnosic Acid (Synthetic) 97.0+%, TCI America™

CAS: 3650-09-7 Molecular Formula: C20H28O4 Molecular Weight (g/mol): 332.44 MDL Number: MFCD02259459 InChI Key: QRYRORQUOLYVBU-VBKZILBWSA-N Synonym: (4aR,10aS)-5,6-Dihydroxy-7-isopropyl-1,1-dimethyl-1,2,3,4,4a,9,10,10a-octahydrophenanthrene-4a-carboxylic Acid PubChem CID: 65126 ChEBI: CHEBI:65585 IUPAC Name: (4aR,10aS)-5,6-dihydroxy-1,1-dimethyl-7-propan-2-yl-2,3,4,9,10,10a-hexahydrophenanthrene-4a-carboxylic acid SMILES: CC(C)C1=C(C(=C2C(=C1)CCC3C2(CCCC3(C)C)C(=O)O)O)O

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Specifications

PubChem CID	65126
CAS	3650-09-7
Molecular Weight (g/mol)	332.44
ChEBI	CHEBI:65585
MDL Number	MFCD02259459
SMILES	CC(C)C1=C(C(=C2C(=C1)CCC3C2(CCCC3(C)C)C(=O)O)O)O
Synonym	(4aR,10aS)-5,6-Dihydroxy-7-isopropyl-1,1-dimethyl-1,2,3,4,4a,9,10,10a-octahydrophenanthrene-4a-carboxylic Acid
IUPAC Name	(4aR,10aS)-5,6-dihydroxy-1,1-dimethyl-7-propan-2-yl-2,3,4,9,10,10a-hexahydrophenanthrene-4a-carboxylic acid
InChI Key	QRYRORQUOLYVBU-VBKZILBWSA-N
Molecular Formula	C20H28O4

2,3,6,7,10,11-Hexamethoxytriphenylene 95.0+%, TCI America™

CAS: 808-57-1 Molecular Formula: C24H24O6 Molecular Weight (g/mol): 408.45 MDL Number: MFCD00075571 InChI Key: TXROZCSFVVIBFI-UHFFFAOYSA-N PubChem CID: 4607363 IUPAC Name: 2,3,6,7,10,11-hexamethoxytriphenylene SMILES: COC1=C(C=C2C(=C1)C3=CC(=C(C=C3C4=CC(=C(C=C24)OC)OC)OC)OC)OC

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Specifications

PubChem CID	4607363
CAS	808-57-1
Molecular Weight (g/mol)	408.45
MDL Number	MFCD00075571
SMILES	COC1=C(C=C2C(=C1)C3=CC(=C(C=C3C4=CC(=C(C=C24)OC)OC)OC)OC)OC
IUPAC Name	2,3,6,7,10,11-hexamethoxytriphenylene
InChI Key	TXROZCSFVVIBFI-UHFFFAOYSA-N
Molecular Formula	C24H24O6

Pisiferic Acid 98.0+%, TCI America™

CAS: 67494-15-9 Molecular Formula: C20H28O3 Molecular Weight (g/mol): 316.441 MDL Number: MFCD01708794 InChI Key: ATHWSPHADLLZSS-PXNSSMCTSA-N PubChem CID: 162209 ChEBI: CHEBI:70576 IUPAC Name: (4aR,10aS)-6-hydroxy-1,1-dimethyl-7-propan-2-yl-2,3,4,9,10,10a-hexahydrophenanthrene-4a-carboxylic acid SMILES: CC(C)C1=C(C=C2C(=C1)CCC3C2(CCCC3(C)C)C(=O)O)O

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Specifications

PubChem CID	162209
CAS	67494-15-9
Molecular Weight (g/mol)	316.441
ChEBI	CHEBI:70576
MDL Number	MFCD01708794
SMILES	CC(C)C1=C(C=C2C(=C1)CCC3C2(CCCC3(C)C)C(=O)O)O
IUPAC Name	(4aR,10aS)-6-hydroxy-1,1-dimethyl-7-propan-2-yl-2,3,4,9,10,10a-hexahydrophenanthrene-4a-carboxylic acid
InChI Key	ATHWSPHADLLZSS-PXNSSMCTSA-N
Molecular Formula	C20H28O3

Dibenzo[b,def]chrysene 98.0+%, TCI America™

CAS: 189-64-0 Molecular Formula: C24H14 Molecular Weight (g/mol): 302.376 MDL Number: MFCD00039579 InChI Key: RXUSYFJGDZFVND-UHFFFAOYSA-N Synonym: dibenzo b,def chrysene,dibenzo a,h pyrene,db a,h p,3,4,8,9-dibenzpyrene,1,2,6,7-dibenzopyrene,3,4,8,9-dibenzopyrene,unii-xr5r3v8bjk,3,4:8,9-dibenzopyrene PubChem CID: 9108 ChEBI: CHEBI:82313 SMILES: C1=CC=C2C3=C4C(=CC2=C1)C=CC5=C4C(=CC6=CC=CC=C56)C=C3

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Specifications

PubChem CID	9108
CAS	189-64-0
Molecular Weight (g/mol)	302.376
ChEBI	CHEBI:82313
MDL Number	MFCD00039579
SMILES	C1=CC=C2C3=C4C(=CC2=C1)C=CC5=C4C(=CC6=CC=CC=C56)C=C3
Synonym	dibenzo b,def chrysene,dibenzo a,h pyrene,db a,h p,3,4,8,9-dibenzpyrene,1,2,6,7-dibenzopyrene,3,4,8,9-dibenzopyrene,unii-xr5r3v8bjk,3,4:8,9-dibenzopyrene
InChI Key	RXUSYFJGDZFVND-UHFFFAOYSA-N
Molecular Formula	C24H14

4,4,5,5-Tetramethyl-2-[3-(triphenylen-2-yl)phenyl]-1,3,2-dioxaborolane 98.0+%, TCI America™

CAS: 1115639-92-3 Molecular Formula: C30H27BO2 Molecular Weight (g/mol): 430.35 MDL Number: MFCD28130383 InChI Key: NZTBACVVLACPNL-UHFFFAOYSA-N Synonym: 2-[3-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]triphenylene PubChem CID: 58489416 IUPAC Name: 4,4,5,5-tetramethyl-2-[3-(triphenylen-2-yl)phenyl]-1,3,2-dioxaborolane SMILES: CC1(C)OB(OC1(C)C)C1=CC(=CC=C1)C1=CC=C2C3=CC=CC=C3C3=CC=CC=C3C2=C1

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PubChem CID	58489416
CAS	1115639-92-3
Molecular Weight (g/mol)	430.35
MDL Number	MFCD28130383
SMILES	CC1(C)OB(OC1(C)C)C1=CC(=CC=C1)C1=CC=C2C3=CC=CC=C3C3=CC=CC=C3C2=C1
Synonym	2-[3-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]triphenylene
IUPAC Name	4,4,5,5-tetramethyl-2-[3-(triphenylen-2-yl)phenyl]-1,3,2-dioxaborolane
InChI Key	NZTBACVVLACPNL-UHFFFAOYSA-N
Molecular Formula	C30H27BO2

Dibenzo[g,p]chrysene 98.0+%, TCI America™

CAS: 191-68-4 Molecular Formula: C26H16 Molecular Weight (g/mol): 328.414 InChI Key: GQDKQZAEQBGVBS-UHFFFAOYSA-N PubChem CID: 67449 SMILES: C1=CC=C2C(=C1)C3=CC=CC=C3C4=C2C5=CC=CC=C5C6=CC=CC=C64

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Specifications

PubChem CID	67449
CAS	191-68-4
Molecular Weight (g/mol)	328.414
SMILES	C1=CC=C2C(=C1)C3=CC=CC=C3C4=C2C5=CC=CC=C5C6=CC=CC=C64
InChI Key	GQDKQZAEQBGVBS-UHFFFAOYSA-N
Molecular Formula	C26H16

Sodium Abietate 95.0+%, TCI America™

CAS: 14351-66-7 Molecular Formula: C20H29NaO2 Molecular Weight (g/mol): 324.44 MDL Number: MFCD00058941 InChI Key: ITCAUAYQCALGGV-XTICBAGASA-M Synonym: Abietic Acid Sodium Salt PubChem CID: 133121851 IUPAC Name: sodium (1R,4aR,4bR,10aR)-1,4a-dimethyl-7-(propan-2-yl)-1,2,3,4,4a,4b,5,6,10,10a-decahydrophenanthrene-1-carboxylate SMILES: [Na+].CC(C)C1=CC2=CC[C@@H]3[C@](C)(CCC[C@@]3(C)C([O-])=O)[C@H]2CC1

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PubChem CID	133121851
CAS	14351-66-7
Molecular Weight (g/mol)	324.44
MDL Number	MFCD00058941
SMILES	[Na+].CC(C)C1=CC2=CC[C@@H]3[C@](C)(CCC[C@@]3(C)C([O-])=O)[C@H]2CC1
Synonym	Abietic Acid Sodium Salt
IUPAC Name	sodium (1R,4aR,4bR,10aR)-1,4a-dimethyl-7-(propan-2-yl)-1,2,3,4,4a,4b,5,6,10,10a-decahydrophenanthrene-1-carboxylate
InChI Key	ITCAUAYQCALGGV-XTICBAGASA-M
Molecular Formula	C20H29NaO2

(+)-Dehydroabietylamine 90.0+%, TCI America™

CAS: 1446-61-3 Molecular Formula: C20H31N Molecular Weight (g/mol): 285.475 MDL Number: MFCD00213430 InChI Key: JVVXZOOGOGPDRZ-SLFFLAALSA-N Synonym: dehydroabietylamine,+-dehydroabietylamine,1r,4as,10ar-7-isopropyl-1,4a-dimethyl-1,2,3,4,4a,9,10,10a-octahydrophenanthren-1-yl methanamine,amine d,dehydroabiethylamine,leelamine,podocarpa-8,11,13-trien-15-amine, 13-isopropyl,1-phenanthrenemethanamine, 1,2,3,4,4a,9,10,10a-octahydro-1,4a-dimethyl-7-1-methylethyl-, 1r,4as,10ar,pubchem7951,4-12-00-03005 beilstein handbook reference PubChem CID: 62034 IUPAC Name: [(1R,4aS,10aR)-1,4a-dimethyl-7-propan-2-yl-2,3,4,9,10,10a-hexahydrophenanthren-1-yl]methanamine SMILES: CC(C)C1=CC2=C(C=C1)C3(CCCC(C3CC2)(C)CN)C

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Specifications

PubChem CID	62034
CAS	1446-61-3
Molecular Weight (g/mol)	285.475
MDL Number	MFCD00213430
SMILES	CC(C)C1=CC2=C(C=C1)C3(CCCC(C3CC2)(C)CN)C
Synonym	dehydroabietylamine,+-dehydroabietylamine,1r,4as,10ar-7-isopropyl-1,4a-dimethyl-1,2,3,4,4a,9,10,10a-octahydrophenanthren-1-yl methanamine,amine d,dehydroabiethylamine,leelamine,podocarpa-8,11,13-trien-15-amine, 13-isopropyl,1-phenanthrenemethanamine, 1,2,3,4,4a,9,10,10a-octahydro-1,4a-dimethyl-7-1-methylethyl-, 1r,4as,10ar,pubchem7951,4-12-00-03005 beilstein handbook reference
IUPAC Name	[(1R,4aS,10aR)-1,4a-dimethyl-7-propan-2-yl-2,3,4,9,10,10a-hexahydrophenanthren-1-yl]methanamine
InChI Key	JVVXZOOGOGPDRZ-SLFFLAALSA-N
Molecular Formula	C20H31N

9,10-Dihydrophenanthrene 96.0+%, TCI America™

CAS: 776-35-2 Molecular Formula: C14H12 Molecular Weight (g/mol): 180.25 MDL Number: MFCD00001164 InChI Key: XXPBFNVKTVJZKF-UHFFFAOYSA-N Synonym: phenanthrene, 9,10-dihydro,unii-brm9tu2f34,9,10-dihydro-phenanthrene,dihydrophenanthrene,brm9tu2f34,acmc-1ba4q,phenanthrene,9,10-dihydro,9,10-dihydrophenanthrene,phenanthrene, 9,10-dihydro-8ci 9ci PubChem CID: 13058 IUPAC Name: 9,10-dihydrophenanthrene SMILES: C1CC2=CC=CC=C2C3=CC=CC=C31

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PubChem CID	13058
CAS	776-35-2
Molecular Weight (g/mol)	180.25
MDL Number	MFCD00001164
SMILES	C1CC2=CC=CC=C2C3=CC=CC=C31
Synonym	phenanthrene, 9,10-dihydro,unii-brm9tu2f34,9,10-dihydro-phenanthrene,dihydrophenanthrene,brm9tu2f34,acmc-1ba4q,phenanthrene,9,10-dihydro,9,10-dihydrophenanthrene,phenanthrene, 9,10-dihydro-8ci 9ci
IUPAC Name	9,10-dihydrophenanthrene
InChI Key	XXPBFNVKTVJZKF-UHFFFAOYSA-N
Molecular Formula	C14H12

2,3,6,7,10,11-Hexahydroxytriphenylene Hydrate 95.0+%, TCI America™

CAS: 4877-80-9 Molecular Formula: C18H12O6 Molecular Weight (g/mol): 324.288 MDL Number: MFCD01321170 InChI Key: QMLILIIMKSKLES-UHFFFAOYSA-N Synonym: 2,3,6,7,10,11-hexahydroxytriphenylene,triphenylene-2,3,6,7,10,11-hexaol,2,3,6,7,10,11-triphenylenehexol,acmc-1ak9f,2,3,6,7,10,11-hexa-hydroxytriphenylene PubChem CID: 11088610 IUPAC Name: triphenylene-2,3,6,7,10,11-hexol SMILES: C1=C2C3=CC(=C(C=C3C4=CC(=C(C=C4C2=CC(=C1O)O)O)O)O)O

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PubChem CID	11088610
CAS	4877-80-9
Molecular Weight (g/mol)	324.288
MDL Number	MFCD01321170
SMILES	C1=C2C3=CC(=C(C=C3C4=CC(=C(C=C4C2=CC(=C1O)O)O)O)O)O
Synonym	2,3,6,7,10,11-hexahydroxytriphenylene,triphenylene-2,3,6,7,10,11-hexaol,2,3,6,7,10,11-triphenylenehexol,acmc-1ak9f,2,3,6,7,10,11-hexa-hydroxytriphenylene
IUPAC Name	triphenylene-2,3,6,7,10,11-hexol
InChI Key	QMLILIIMKSKLES-UHFFFAOYSA-N
Molecular Formula	C18H12O6

C60MC12 97.0+%, TCI America™

CAS: 403483-19-2 Molecular Formula: C81H35N Molecular Weight (g/mol): 1022.178 InChI Key: YDAHEEMFHYNKKQ-UHFFFAOYSA-N Synonym: C60-fused N-Methylpyrrolidine-m-C12-phenyl PubChem CID: 53384414 SMILES: CCCCCCCCCCCCC1=CC=CC(=C1)C2C34C5=C6C7=C8C5=C9C1=C5C%10=C%11C%12=C%13C%10=C%10C1=C8C1=C8C7=C7C%14=C8C8=C%15C(=C%13C8=C%101)C1=C%12C8=C%10C1=C1C%15=C%14C%12=C1C1=C%10C%10=C%13C8=C%11C8=C5C9=C3C(=C%138)C3=C%10C1=C1C%12=C7C6=C1C43CN2C

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Specifications

PubChem CID	53384414
CAS	403483-19-2
Molecular Weight (g/mol)	1022.178
SMILES	CCCCCCCCCCCCC1=CC=CC(=C1)C2C34C5=C6C7=C8C5=C9C1=C5C%10=C%11C%12=C%13C%10=C%10C1=C8C1=C8C7=C7C%14=C8C8=C%15C(=C%13C8=C%101)C1=C%12C8=C%10C1=C1C%15=C%14C%12=C1C1=C%10C%10=C%13C8=C%11C8=C5C9=C3C(=C%138)C3=C%10C1=C1C%12=C7C6=C1C43CN2C
Synonym	C60-fused N-Methylpyrrolidine-m-C12-phenyl
InChI Key	YDAHEEMFHYNKKQ-UHFFFAOYSA-N
Molecular Formula	C81H35N

9,10-Phenanthrenequinone 98.0+%, TCI America™

CAS: 84-11-7 Molecular Formula: C14H8O2 Molecular Weight (g/mol): 208.216 MDL Number: MFCD00001163 InChI Key: YYVYAPXYZVYDHN-UHFFFAOYSA-N Synonym: 9,10-phenanthrenequinone,phenanthrenequinone,9,10-phenanthrenedione,9,10-phenanthraquinone,phenanthraquinone,9,10-phenanthroquinone,9-10 phenanthrene quinone,unii-42l7bz8h74,ccris 7615,phenanthrene, 9,10-dihydro-9,10-dioxo PubChem CID: 6763 ChEBI: CHEBI:37454 IUPAC Name: phenanthrene-9,10-dione SMILES: C1=CC=C2C(=C1)C3=CC=CC=C3C(=O)C2=O

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PubChem CID	6763
CAS	84-11-7
Molecular Weight (g/mol)	208.216
ChEBI	CHEBI:37454
MDL Number	MFCD00001163
SMILES	C1=CC=C2C(=C1)C3=CC=CC=C3C(=O)C2=O
Synonym	9,10-phenanthrenequinone,phenanthrenequinone,9,10-phenanthrenedione,9,10-phenanthraquinone,phenanthraquinone,9,10-phenanthroquinone,9-10 phenanthrene quinone,unii-42l7bz8h74,ccris 7615,phenanthrene, 9,10-dihydro-9,10-dioxo
IUPAC Name	phenanthrene-9,10-dione
InChI Key	YYVYAPXYZVYDHN-UHFFFAOYSA-N
Molecular Formula	C14H8O2

Triphenylene 96.0+%, TCI America™

CAS: 217-59-4 Molecular Formula: C18H12 Molecular Weight (g/mol): 228.29 MDL Number: MFCD00001108 InChI Key: SLGBZMMZGDRARJ-UHFFFAOYSA-N Synonym: 9,10-benzophenanthrene,isochrysene,9,10-benzphenanthrene,benzo l phenanthrene,1,2,3,4-dibenznaphthalene,benzophenanthrene,1,2:3,4-dibenznaphthalene,ccris 1301,triphenylen-1-yl PubChem CID: 9170 ChEBI: CHEBI:33080 IUPAC Name: triphenylene SMILES: C1=CC=C2C(=C1)C1=CC=CC=C1C1=CC=CC=C21

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Specifications

PubChem CID	9170
CAS	217-59-4
Molecular Weight (g/mol)	228.29
ChEBI	CHEBI:33080
MDL Number	MFCD00001108
SMILES	C1=CC=C2C(=C1)C1=CC=CC=C1C1=CC=CC=C21
Synonym	9,10-benzophenanthrene,isochrysene,9,10-benzphenanthrene,benzo l phenanthrene,1,2,3,4-dibenznaphthalene,benzophenanthrene,1,2:3,4-dibenznaphthalene,ccris 1301,triphenylen-1-yl
IUPAC Name	triphenylene
InChI Key	SLGBZMMZGDRARJ-UHFFFAOYSA-N
Molecular Formula	C18H12

2-Triphenylenecarboxaldehyde 98.0+%, TCI America™

CAS: 96404-79-4 Molecular Formula: C19H12O Molecular Weight (g/mol): 256.30 MDL Number: MFCD29089374 InChI Key: NXDGVEYXRSKONY-UHFFFAOYSA-N PubChem CID: 13375435 IUPAC Name: triphenylene-2-carbaldehyde SMILES: O=CC1=CC=C2C3=CC=CC=C3C3=CC=CC=C3C2=C1

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Specifications

PubChem CID	13375435
CAS	96404-79-4
Molecular Weight (g/mol)	256.30
MDL Number	MFCD29089374
SMILES	O=CC1=CC=C2C3=CC=CC=C3C3=CC=CC=C3C2=C1
IUPAC Name	triphenylene-2-carbaldehyde
InChI Key	NXDGVEYXRSKONY-UHFFFAOYSA-N
Molecular Formula	C19H12O

2,3,6,7,10,11-Hexakis(hexyloxy)triphenylene 98.0+%, TCI America™

CAS: 70351-86-9 Molecular Formula: C54H84O6 Molecular Weight (g/mol): 829.26 MDL Number: MFCD16250223 InChI Key: SQYCPYUKCAKHRN-UHFFFAOYSA-N PubChem CID: 10941839 IUPAC Name: 2,3,6,7,10,11-hexakis(hexyloxy)triphenylene SMILES: CCCCCCOC1=C(OCCCCCC)C=C2C(=C1)C1=CC(OCCCCCC)=C(OCCCCCC)C=C1C1=CC(OCCCCCC)=C(OCCCCCC)C=C21

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Specifications

PubChem CID	10941839
CAS	70351-86-9
Molecular Weight (g/mol)	829.26
MDL Number	MFCD16250223
SMILES	CCCCCCOC1=C(OCCCCCC)C=C2C(=C1)C1=CC(OCCCCCC)=C(OCCCCCC)C=C1C1=CC(OCCCCCC)=C(OCCCCCC)C=C21
IUPAC Name	2,3,6,7,10,11-hexakis(hexyloxy)triphenylene
InChI Key	SQYCPYUKCAKHRN-UHFFFAOYSA-N
Molecular Formula	C54H84O6

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