Unclassified Organic Compounds

Organic compounds that do not fit into any other organic chemical classification.

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3,481 – 3,495 of 162,937 results

3,481

3,4-Bis(4-acetoxyphenyl)-2,4-hexadiene 95.0+%, TCI America™

CAS: 84-19-5 Molecular Formula: C22H22O4 Molecular Weight (g/mol): 350.414 MDL Number: MFCD00063286 InChI Key: YWLLGDVBTLPARJ-LWKKFVLGSA-N Synonym: Dienestrol Diacetate PubChem CID: 24884313 IUPAC Name: [4-[(2Z,4E)-4-(4-acetyloxyphenyl)hexa-2,4-dien-3-yl]phenyl] acetate SMILES: CC=C(C1=CC=C(C=C1)OC(=O)C)C(=CC)C2=CC=C(C=C2)OC(=O)C

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Specifications

PubChem CID	24884313
CAS	84-19-5
Molecular Weight (g/mol)	350.414
MDL Number	MFCD00063286
SMILES	CC=C(C1=CC=C(C=C1)OC(=O)C)C(=CC)C2=CC=C(C=C2)OC(=O)C
Synonym	Dienestrol Diacetate
IUPAC Name	[4-[(2Z,4E)-4-(4-acetyloxyphenyl)hexa-2,4-dien-3-yl]phenyl] acetate
InChI Key	YWLLGDVBTLPARJ-LWKKFVLGSA-N
Molecular Formula	C22H22O4

3,482

2,3-Dimethylheptane 99.0+%, TCI America™

CAS: 3074-71-3 Molecular Formula: C9H20 Molecular Weight (g/mol): 128.259 MDL Number: MFCD00048819 InChI Key: WBRFDUJXCLCKPX-UHFFFAOYSA-N PubChem CID: 26375 IUPAC Name: 2,3-dimethylheptane SMILES: CCCCC(C)C(C)C

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Specifications

PubChem CID	26375
CAS	3074-71-3
Molecular Weight (g/mol)	128.259
MDL Number	MFCD00048819
SMILES	CCCCC(C)C(C)C
IUPAC Name	2,3-dimethylheptane
InChI Key	WBRFDUJXCLCKPX-UHFFFAOYSA-N
Molecular Formula	C9H20

3,483

Methyl Aziridine-2-carboxylate (stabilized with HQ) 97.0+%, TCI America™

CAS: 5950-34-5 Molecular Formula: C4H7NO2 Molecular Weight (g/mol): 101.105 MDL Number: MFCD00143640 InChI Key: ZWCVDRJTYFIPIV-UHFFFAOYSA-N Synonym: Aziridine-2-carboxylic Acid Methyl Ester, 2-Methoxycarbonylaziridine PubChem CID: 534940 IUPAC Name: methyl aziridine-2-carboxylate SMILES: COC(=O)C1CN1

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Specifications

PubChem CID	534940
CAS	5950-34-5
Molecular Weight (g/mol)	101.105
MDL Number	MFCD00143640
SMILES	COC(=O)C1CN1
Synonym	Aziridine-2-carboxylic Acid Methyl Ester, 2-Methoxycarbonylaziridine
IUPAC Name	methyl aziridine-2-carboxylate
InChI Key	ZWCVDRJTYFIPIV-UHFFFAOYSA-N
Molecular Formula	C4H7NO2

3,484

(S)-(+)-3-Chloro-1,2-propanediol 98.0+%, TCI America™

CAS: 60827-45-4 Molecular Formula: C3H7ClO2 Molecular Weight (g/mol): 110.537 MDL Number: MFCD00210270 InChI Key: SSZWWUDQMAHNAQ-GSVOUGTGSA-N Synonym: s-+-3-chloro-1,2-propanediol,s-3-chloro-1,2-propanediol,s-3-chloropropane-1,2-diol,2s-3-chloropropane-1,2-diol,s-alpha-chlorohydrin,unii-227bd3h6h6,ccris 7386,1,2-propanediol, 3-chloro-, s,1,2-propanediol, 3-chloro-, 2s PubChem CID: 148904 IUPAC Name: (2S)-3-chloropropane-1,2-diol SMILES: C(C(CCl)O)O

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Specifications

PubChem CID	148904
CAS	60827-45-4
Molecular Weight (g/mol)	110.537
MDL Number	MFCD00210270
SMILES	C(C(CCl)O)O
Synonym	s-+-3-chloro-1,2-propanediol,s-3-chloro-1,2-propanediol,s-3-chloropropane-1,2-diol,2s-3-chloropropane-1,2-diol,s-alpha-chlorohydrin,unii-227bd3h6h6,ccris 7386,1,2-propanediol, 3-chloro-, s,1,2-propanediol, 3-chloro-, 2s
IUPAC Name	(2S)-3-chloropropane-1,2-diol
InChI Key	SSZWWUDQMAHNAQ-GSVOUGTGSA-N
Molecular Formula	C3H7ClO2

3,485

2-(2-Hydroxyphenyl)benzothiazole 98.0+%, TCI America™

CAS: 3411-95-8 Molecular Formula: C13H9NOS Molecular Weight (g/mol): 227.28 MDL Number: MFCD00022869 InChI Key: NSDGEQWRYXOZLN-UKTHLTGXSA-N Synonym: phenol, o-2-benzothiazolyl,2-2-hydroxyphenyl benzothiazole,o-2-benzothiazolyl phenol,phenol, 2-2-benzothiazolyl,2-2-benzothiazolyl phenol,2-o-hydroxyphenyl benzothiazole,2-2'-hydroxyphenyl benzothiazole,2-1,3-benzothiazol-2-yl phenol,6z-6-3h-1,3-benzothiazol-2-ylidene cyclohexa-2,4-dien-1-one,mvvgspcxhrfddr-uhfffaoysa-n PubChem CID: 5376551 IUPAC Name: 6-[(2E)-2,3-dihydro-1,3-benzothiazol-2-ylidene]cyclohexa-2,4-dien-1-one SMILES: O=C1C=CC=C\C1=C1\NC2=CC=CC=C2S1

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Specifications

PubChem CID	5376551
CAS	3411-95-8
Molecular Weight (g/mol)	227.28
MDL Number	MFCD00022869
SMILES	O=C1C=CC=C\C1=C1\NC2=CC=CC=C2S1
Synonym	phenol, o-2-benzothiazolyl,2-2-hydroxyphenyl benzothiazole,o-2-benzothiazolyl phenol,phenol, 2-2-benzothiazolyl,2-2-benzothiazolyl phenol,2-o-hydroxyphenyl benzothiazole,2-2'-hydroxyphenyl benzothiazole,2-1,3-benzothiazol-2-yl phenol,6z-6-3h-1,3-benzothiazol-2-ylidene cyclohexa-2,4-dien-1-one,mvvgspcxhrfddr-uhfffaoysa-n
IUPAC Name	6-[(2E)-2,3-dihydro-1,3-benzothiazol-2-ylidene]cyclohexa-2,4-dien-1-one
InChI Key	NSDGEQWRYXOZLN-UKTHLTGXSA-N
Molecular Formula	C13H9NOS

3,486

Ethyl 1-Methylpipecolate 97.0+%, TCI America™

CAS: 30727-18-5 Molecular Formula: C9H18NO2 Molecular Weight (g/mol): 172.25 MDL Number: MFCD00006492 InChI Key: ZICBNHLULHJETL-MRVPVSSYSA-O Synonym: ethyl 1-methylpipecolinate,ethyl 1-methyl-2-piperidinecarboxylate,ethyl n-methylpipecolinate,ethyl 1-methylpipecolate,2-piperidinecarboxylic acid, 1-methyl-, ethyl ester,1-methylpipecolic acid ethyl ester,pubchem11770,methyl 1-methyl piperidine-2-carboxylate,acmc-209hid,ksc495g6f PubChem CID: 566742 IUPAC Name: (2R)-2-(ethoxycarbonyl)-1-methylpiperidin-1-ium SMILES: CCOC(=O)[C@H]1CCCC[NH+]1C

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Specifications

PubChem CID	566742
CAS	30727-18-5
Molecular Weight (g/mol)	172.25
MDL Number	MFCD00006492
SMILES	CCOC(=O)[C@H]1CCCC[NH+]1C
Synonym	ethyl 1-methylpipecolinate,ethyl 1-methyl-2-piperidinecarboxylate,ethyl n-methylpipecolinate,ethyl 1-methylpipecolate,2-piperidinecarboxylic acid, 1-methyl-, ethyl ester,1-methylpipecolic acid ethyl ester,pubchem11770,methyl 1-methyl piperidine-2-carboxylate,acmc-209hid,ksc495g6f
IUPAC Name	(2R)-2-(ethoxycarbonyl)-1-methylpiperidin-1-ium
InChI Key	ZICBNHLULHJETL-MRVPVSSYSA-O
Molecular Formula	C9H18NO2

3,487

Azocal A [for Calcium determination], TCI America™

CAS: 1836-22-2 Molecular Formula: C17H9N2Na3O9S2 Molecular Weight (g/mol): 518.35 MDL Number: MFCD00046379 InChI Key: SJYYQLRKEKKFSX-NETMGOMMSA-K PubChem CID: 131850130 IUPAC Name: trisodium 2-{2-[(1Z)-2-oxo-3,6-disulfonato-1,2-dihydronaphthalen-1-ylidene]hydrazin-1-yl}benzoate SMILES: [Na+].[Na+].[Na+].[O-]C(=O)C1=CC=CC=C1N\N=C1/C(=O)C(=CC2=CC(=CC=C12)S([O-])(=O)=O)S([O-])(=O)=O

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Specifications

PubChem CID	131850130
CAS	1836-22-2
Molecular Weight (g/mol)	518.35
MDL Number	MFCD00046379
SMILES	[Na+].[Na+].[Na+].[O-]C(=O)C1=CC=CC=C1N\N=C1/C(=O)C(=CC2=CC(=CC=C12)S([O-])(=O)=O)S([O-])(=O)=O
IUPAC Name	trisodium 2-{2-[(1Z)-2-oxo-3,6-disulfonato-1,2-dihydronaphthalen-1-ylidene]hydrazin-1-yl}benzoate
InChI Key	SJYYQLRKEKKFSX-NETMGOMMSA-K
Molecular Formula	C17H9N2Na3O9S2

3,488

2-(2-Hydroxy-4-methoxyphenyl)-4,6-diphenyl-1,3,5-triazine 98.0+%, TCI America™

CAS: 106556-36-9 Molecular Formula: C22H17N3O2 Molecular Weight (g/mol): 355.397 MDL Number: MFCD23102325 InChI Key: SLVHGNKODJJKEZ-UHFFFAOYSA-N PubChem CID: 53424132 IUPAC Name: 6-(4,6-diphenyl-1H-1,3,5-triazin-2-ylidene)-3-methoxycyclohexa-2,4-dien-1-one SMILES: COC1=CC(=O)C(=C2NC(=NC(=N2)C3=CC=CC=C3)C4=CC=CC=C4)C=C1

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Specifications

PubChem CID	53424132
CAS	106556-36-9
Molecular Weight (g/mol)	355.397
MDL Number	MFCD23102325
SMILES	COC1=CC(=O)C(=C2NC(=NC(=N2)C3=CC=CC=C3)C4=CC=CC=C4)C=C1
IUPAC Name	6-(4,6-diphenyl-1H-1,3,5-triazin-2-ylidene)-3-methoxycyclohexa-2,4-dien-1-one
InChI Key	SLVHGNKODJJKEZ-UHFFFAOYSA-N
Molecular Formula	C22H17N3O2

3,489

Heptatriacontane 95.0+%, TCI America™

CAS: 7194-84-5 Molecular Formula: C37H76 Molecular Weight (g/mol): 521.015 MDL Number: MFCD00042945 InChI Key: PXEZIKSRSYGOED-UHFFFAOYSA-N PubChem CID: 23598 IUPAC Name: heptatriacontane SMILES: CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC

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Specifications

PubChem CID	23598
CAS	7194-84-5
Molecular Weight (g/mol)	521.015
MDL Number	MFCD00042945
SMILES	CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC
IUPAC Name	heptatriacontane
InChI Key	PXEZIKSRSYGOED-UHFFFAOYSA-N
Molecular Formula	C37H76

3,490

Sesamin 98.0+%, TCI America™

CAS: 607-80-7 Molecular Formula: C20H18O6 Molecular Weight (g/mol): 354.358 MDL Number: MFCD00216134 InChI Key: PEYUIKBAABKQKQ-USWSZDBUSA-N PubChem CID: 44714838 IUPAC Name: 5-[(3S,3aR,6aR)-3-(1,3-benzodioxol-5-yl)-1,3,3a,4,6,6a-hexahydrofuro[3,4-c]furan-6-yl]-1,3-benzodioxole SMILES: C1C2C(COC2C3=CC4=C(C=C3)OCO4)C(O1)C5=CC6=C(C=C5)OCO6

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Specifications

PubChem CID	44714838
CAS	607-80-7
Molecular Weight (g/mol)	354.358
MDL Number	MFCD00216134
SMILES	C1C2C(COC2C3=CC4=C(C=C3)OCO4)C(O1)C5=CC6=C(C=C5)OCO6
IUPAC Name	5-[(3S,3aR,6aR)-3-(1,3-benzodioxol-5-yl)-1,3,3a,4,6,6a-hexahydrofuro[3,4-c]furan-6-yl]-1,3-benzodioxole
InChI Key	PEYUIKBAABKQKQ-USWSZDBUSA-N
Molecular Formula	C20H18O6

3,491

Carbon Nanotube Multi-walled 60-100nm(diam.), >5micro m(length), TCI America™

CAS: 308068-56-6 Molecular Formula: CH4 Molecular Weight (g/mol): 16.043 InChI Key: VNWKTOKETHGBQD-UHFFFAOYSA-N Synonym: methyl hydride,marsh gas,biogas,fire damp,r 50 refrigerant,methan,metano,hsdb 167,in gaseus state,tetrahydridocarbon PubChem CID: 297 ChEBI: CHEBI:16183 IUPAC Name: methane SMILES: C

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Specifications

PubChem CID	297
CAS	308068-56-6
Molecular Weight (g/mol)	16.043
ChEBI	CHEBI:16183
SMILES	C
Synonym	methyl hydride,marsh gas,biogas,fire damp,r 50 refrigerant,methan,metano,hsdb 167,in gaseus state,tetrahydridocarbon
IUPAC Name	methane
InChI Key	VNWKTOKETHGBQD-UHFFFAOYSA-N
Molecular Formula	CH4

3,492

D 102 96.0+%, TCI America™

CAS: 652145-28-3 Molecular Formula: C37H30N2O3S2 Molecular Weight (g/mol): 614.778 InChI Key: XGMCROHUTRXETK-VQNDASPWSA-N Synonym: 2-[5-[[4-[4-(2,2-Diphenylvinyl)phenyl]-1,2,3,3a,4,8b-hexahydrocyclopenta[b]indol-7-yl]methylene]-4-oxo-2-thioxothiazolidin-3-yl]acetic Acid PubChem CID: 57937215 IUPAC Name: 2-[(5Z)-5-[[4-[4-(2,2-diphenylethenyl)phenyl]-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indol-7-yl]methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]acetic acid SMILES: C1CC2C(C1)N(C3=C2C=C(C=C3)C=C4C(=O)N(C(=S)S4)CC(=O)O)C5=CC=C(C=C5)C=C(C6=CC=CC=C6)C7=CC=CC=C7

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Specifications

PubChem CID	57937215
CAS	652145-28-3
Molecular Weight (g/mol)	614.778
SMILES	C1CC2C(C1)N(C3=C2C=C(C=C3)C=C4C(=O)N(C(=S)S4)CC(=O)O)C5=CC=C(C=C5)C=C(C6=CC=CC=C6)C7=CC=CC=C7
Synonym	2-[5-[[4-[4-(2,2-Diphenylvinyl)phenyl]-1,2,3,3a,4,8b-hexahydrocyclopenta[b]indol-7-yl]methylene]-4-oxo-2-thioxothiazolidin-3-yl]acetic Acid
IUPAC Name	2-[(5Z)-5-[[4-[4-(2,2-diphenylethenyl)phenyl]-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indol-7-yl]methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]acetic acid
InChI Key	XGMCROHUTRXETK-VQNDASPWSA-N
Molecular Formula	C37H30N2O3S2

3,493

2,6-Di(1-pyrazolyl)pyridine 98.0+%, TCI America™

CAS: 123640-38-0 Molecular Formula: C11H9N5 Molecular Weight (g/mol): 211.228 InChI Key: OMNFEFLKDQUMRN-UHFFFAOYSA-N PubChem CID: 11816656 IUPAC Name: 2,6-di(pyrazol-1-yl)pyridine SMILES: C1=CC(=NC(=C1)N2C=CC=N2)N3C=CC=N3

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Specifications

PubChem CID	11816656
CAS	123640-38-0
Molecular Weight (g/mol)	211.228
SMILES	C1=CC(=NC(=C1)N2C=CC=N2)N3C=CC=N3
IUPAC Name	2,6-di(pyrazol-1-yl)pyridine
InChI Key	OMNFEFLKDQUMRN-UHFFFAOYSA-N
Molecular Formula	C11H9N5

3,494

4-Ethylcyclohexanone 98.0+%, TCI America™

CAS: 5441-51-0 Molecular Formula: C8H14O Molecular Weight (g/mol): 126.20 MDL Number: MFCD00001644 InChI Key: OKSDJGWHKXFVME-UHFFFAOYSA-N Synonym: 4-ethylcyclohexanone,cyclohexanone, 4-ethyl,4-ethyl cyclohexanone,4-ethyl-cyclohexanone,1-ethyl-4-oxocyclohexane,trans-4-ethylcyclohexanone,acmc-1aru9,ksc273s8l,5-ethyl-2-oxocyclohexyl PubChem CID: 79506 IUPAC Name: 4-ethylcyclohexan-1-one SMILES: CCC1CCC(=O)CC1

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Specifications

PubChem CID	79506
CAS	5441-51-0
Molecular Weight (g/mol)	126.20
MDL Number	MFCD00001644
SMILES	CCC1CCC(=O)CC1
Synonym	4-ethylcyclohexanone,cyclohexanone, 4-ethyl,4-ethyl cyclohexanone,4-ethyl-cyclohexanone,1-ethyl-4-oxocyclohexane,trans-4-ethylcyclohexanone,acmc-1aru9,ksc273s8l,5-ethyl-2-oxocyclohexyl
IUPAC Name	4-ethylcyclohexan-1-one
InChI Key	OKSDJGWHKXFVME-UHFFFAOYSA-N
Molecular Formula	C8H14O

3,495

Isobutylcyclohexane 98.0+%, TCI America™

CAS: 1678-98-4 Molecular Formula: C10H20 Molecular Weight (g/mol): 140.27 MDL Number: MFCD00013767 InChI Key: FFROMNOQCNVNIH-UHFFFAOYSA-N Synonym: isobutylcyclohexane,cyclohexane, isobutyl,cyclohexane, 2-methylpropyl,i-butylcyclohexane,acmc-209dx9,2-methyl-propyl-cyclohexane PubChem CID: 15508 IUPAC Name: 2-methylpropylcyclohexane SMILES: CC(C)CC1CCCCC1

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Specifications

PubChem CID	15508
CAS	1678-98-4
Molecular Weight (g/mol)	140.27
MDL Number	MFCD00013767
SMILES	CC(C)CC1CCCCC1
Synonym	isobutylcyclohexane,cyclohexane, isobutyl,cyclohexane, 2-methylpropyl,i-butylcyclohexane,acmc-209dx9,2-methyl-propyl-cyclohexane
IUPAC Name	2-methylpropylcyclohexane
InChI Key	FFROMNOQCNVNIH-UHFFFAOYSA-N
Molecular Formula	C10H20

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