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 295 results

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

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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Specifications

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

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

2,7-Dibromophenanthrene-9,10-dione 97.0+%, TCI America™

CAS: 84405-44-7 Molecular Formula: C14H6Br2O2 Molecular Weight (g/mol): 366.01 MDL Number: MFCD03931078 InChI Key: LTZIIBSPYWTOQV-UHFFFAOYSA-N PubChem CID: 265843 IUPAC Name: 2,7-dibromo-9,10-dihydrophenanthrene-9,10-dione SMILES: BrC1=CC=C2C3=CC=C(Br)C=C3C(=O)C(=O)C2=C1

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Specifications

PubChem CID	265843
CAS	84405-44-7
Molecular Weight (g/mol)	366.01
MDL Number	MFCD03931078
SMILES	BrC1=CC=C2C3=CC=C(Br)C=C3C(=O)C(=O)C2=C1
IUPAC Name	2,7-dibromo-9,10-dihydrophenanthrene-9,10-dione
InChI Key	LTZIIBSPYWTOQV-UHFFFAOYSA-N
Molecular Formula	C14H6Br2O2

3,4-Benzopyrene (purified by sublimation) 95.0+%, TCI America™

CAS: 50-32-8 Molecular Formula: C20H12 Molecular Weight (g/mol): 252.32 MDL Number: MFCD00003602 InChI Key: FMMWHPNWAFZXNH-UHFFFAOYSA-N Synonym: benzo a pyrene,3,4-benzopyrene,benzo pqr tetraphene,3,4-benzpyrene,benzpyrene,benzo def chrysene,6,7-benzopyrene,benz a pyrene,3,4-benz a pyrene PubChem CID: 2336 ChEBI: CHEBI:29865 IUPAC Name: pentacyclo[10.6.2.0²,⁷.0⁹,¹⁹.0¹⁶,²⁰]icosa-1(18),2,4,6,8,10,12,14,16,19-decaene SMILES: C1=CC=C2C(=C1)C=C1C=CC3=CC=CC4=CC=C2C1=C34

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Specifications

PubChem CID	2336
CAS	50-32-8
Molecular Weight (g/mol)	252.32
ChEBI	CHEBI:29865
MDL Number	MFCD00003602
SMILES	C1=CC=C2C(=C1)C=C1C=CC3=CC=CC4=CC=C2C1=C34
Synonym	benzo a pyrene,3,4-benzopyrene,benzo pqr tetraphene,3,4-benzpyrene,benzpyrene,benzo def chrysene,6,7-benzopyrene,benz a pyrene,3,4-benz a pyrene
IUPAC Name	pentacyclo[10.6.2.0²,⁷.0⁹,¹⁹.0¹⁶,²⁰]icosa-1(18),2,4,6,8,10,12,14,16,19-decaene
InChI Key	FMMWHPNWAFZXNH-UHFFFAOYSA-N
Molecular Formula	C20H12

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-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

3,6-Dibromo-9-(triphenylen-2-yl)carbazole 98.0+%, TCI America™

CAS: 1351870-16-0 Molecular Formula: C30H17Br2N Molecular Weight (g/mol): 551.281 InChI Key: SXVSFEPJEUWLCL-UHFFFAOYSA-N PubChem CID: 89492331 IUPAC Name: 3,6-dibromo-9-triphenylen-2-ylcarbazole SMILES: C1=CC=C2C(=C1)C3=C(C=C(C=C3)N4C5=C(C=C(C=C5)Br)C6=C4C=CC(=C6)Br)C7=CC=CC=C27

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Specifications

PubChem CID	89492331
CAS	1351870-16-0
Molecular Weight (g/mol)	551.281
SMILES	C1=CC=C2C(=C1)C3=C(C=C(C=C3)N4C5=C(C=C(C=C5)Br)C6=C4C=CC(=C6)Br)C7=CC=CC=C27
IUPAC Name	3,6-dibromo-9-triphenylen-2-ylcarbazole
InChI Key	SXVSFEPJEUWLCL-UHFFFAOYSA-N
Molecular Formula	C30H17Br2N

Picene (purified by sublimation) (>99.9%) 99.9+%, TCI America™

CAS: 213-46-7 Molecular Formula: C22H14 Molecular Weight (g/mol): 278.354 MDL Number: MFCD00215857 InChI Key: GBROPGWFBFCKAG-UHFFFAOYSA-N Synonym: 3,4-benzchrysene,pycene,benzo a chrysene,1,2:7,8-dibenzophenanthrene,beta,beta-binaphthyleneethene,dibenzo a,i phenanthrene,1,2,7,8-dibenzphenanthrene,unii-f70r8zbr7t,f70r8zbr7t PubChem CID: 9162 ChEBI: CHEBI:33090 IUPAC Name: picene SMILES: C1=CC=C2C(=C1)C=CC3=C2C=CC4=C3C=CC5=CC=CC=C54

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Specifications

PubChem CID	9162
CAS	213-46-7
Molecular Weight (g/mol)	278.354
ChEBI	CHEBI:33090
MDL Number	MFCD00215857
SMILES	C1=CC=C2C(=C1)C=CC3=C2C=CC4=C3C=CC5=CC=CC=C54
Synonym	3,4-benzchrysene,pycene,benzo a chrysene,1,2:7,8-dibenzophenanthrene,beta,beta-binaphthyleneethene,dibenzo a,i phenanthrene,1,2,7,8-dibenzphenanthrene,unii-f70r8zbr7t,f70r8zbr7t
IUPAC Name	picene
InChI Key	GBROPGWFBFCKAG-UHFFFAOYSA-N
Molecular Formula	C22H14

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

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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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

Violanthrone 79 95.0+%, TCI America™

CAS: 85652-50-2 Molecular Formula: C50H48O4 Molecular Weight (g/mol): 712.93 MDL Number: MFCD00491570 InChI Key: LLPQZABTDLOYAL-UHFFFAOYSA-N Synonym: violanthrone-79,violanthrone 79,anthra 9,1,2-cde benzo rst pentaphene-5,10-dione,16,17-bis octyloxy,anthra 9,1,2-cde benzo rst pentaphene-5,10-dione,1,16,17-bis n-octyloxy anthra 9,1,2-cde benzo rst pentaphene-5,10-dione,16,17-bis octyloxy-anthra 9,1,2-cde benzo rst pentaphene-5,10-dione,16,17-bis octyloxy anthra 9,1,2-cde-benzo rst pentaphene-5,10-dione,16,17-bis octyloxy anthra 9,1,2-cde benzo rst pentaphene-5,10-dione PubChem CID: 16217791 SMILES: CCCCCCCCOC1=C2C3=C(C=CC4=C3C(=C1)C5=CC=CC=C5C4=O)C6=C7C2=C(C=C8C7=C(C=C6)C(=O)C9=CC=CC=C98)OCCCCCCCC

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Specifications

PubChem CID	16217791
CAS	85652-50-2
Molecular Weight (g/mol)	712.93
MDL Number	MFCD00491570
SMILES	CCCCCCCCOC1=C2C3=C(C=CC4=C3C(=C1)C5=CC=CC=C5C4=O)C6=C7C2=C(C=C8C7=C(C=C6)C(=O)C9=CC=CC=C98)OCCCCCCCC
Synonym	violanthrone-79,violanthrone 79,anthra 9,1,2-cde benzo rst pentaphene-5,10-dione,16,17-bis octyloxy,anthra 9,1,2-cde benzo rst pentaphene-5,10-dione,1,16,17-bis n-octyloxy anthra 9,1,2-cde benzo rst pentaphene-5,10-dione,16,17-bis octyloxy-anthra 9,1,2-cde benzo rst pentaphene-5,10-dione,16,17-bis octyloxy anthra 9,1,2-cde-benzo rst pentaphene-5,10-dione,16,17-bis octyloxy anthra 9,1,2-cde benzo rst pentaphene-5,10-dione
InChI Key	LLPQZABTDLOYAL-UHFFFAOYSA-N
Molecular Formula	C50H48O4

Ethyl Abietate 80.0+%, TCI America™

CAS: 631-71-0 Molecular Formula: C22H34O2 Molecular Weight (g/mol): 330.51 MDL Number: MFCD00028860 InChI Key: AGUBCDYYAKENKG-YVNJGZBMSA-N Synonym: Abietic Acid Ethyl Ester, Ethyl Rosinate, Rosin Acid Ethyl Ester PubChem CID: 53642177 IUPAC Name: ethyl (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: CCOC(=O)[C@]1(C)CCC[C@]2(C)[C@H]3CCC(=CC3=CC[C@@H]12)C(C)C

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Specifications

PubChem CID	53642177
CAS	631-71-0
Molecular Weight (g/mol)	330.51
MDL Number	MFCD00028860
SMILES	CCOC(=O)[C@]1(C)CCC[C@]2(C)[C@H]3CCC(=CC3=CC[C@@H]12)C(C)C
Synonym	Abietic Acid Ethyl Ester, Ethyl Rosinate, Rosin Acid Ethyl Ester
IUPAC Name	ethyl (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	AGUBCDYYAKENKG-YVNJGZBMSA-N
Molecular Formula	C22H34O2

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

ICBA 98.5+%, TCI America™

CAS: 1207461-57-1 Molecular Formula: C78H16 Molecular Weight (g/mol): 952.986 MDL Number: MFCD20264904 InChI Key: HQCAMIYWHBVPQE-UHFFFAOYSA-N PubChem CID: 91972098 SMILES: C1C2C3=CC=CC=C3C1C45C26C7=C8C9=C1C2=C3C8=C8C6=C6C4=C4C%10=C%11C%12=C%13C%14=C%15C%16=C%17C(=C1C1=C2C2=C%18C%19=C%20C2=C3C8=C2C%20=C(C%10=C26)C2=C%11C3=C%13C%15=C6C%17=C1C%181C6(C3=C2%19)C2CC1C1=CC=CC=C21)C1=C%16C2=C%14C(=C%124)C5=C2C7=C19

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Specifications

PubChem CID	91972098
CAS	1207461-57-1
Molecular Weight (g/mol)	952.986
MDL Number	MFCD20264904
SMILES	C1C2C3=CC=CC=C3C1C45C26C7=C8C9=C1C2=C3C8=C8C6=C6C4=C4C%10=C%11C%12=C%13C%14=C%15C%16=C%17C(=C1C1=C2C2=C%18C%19=C%20C2=C3C8=C2C%20=C(C%10=C26)C2=C%11C3=C%13C%15=C6C%17=C1C%181C6(C3=C2%19)C2CC1C1=CC=CC=C21)C1=C%16C2=C%14C(=C%124)C5=C2C7=C19
InChI Key	HQCAMIYWHBVPQE-UHFFFAOYSA-N
Molecular Formula	C78H16

Phenanthrenes and derivatives

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