Unclassified Organic Compounds

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

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3,391 – 3,405 of 202,906 results

3,391

Di-tert-Butylsilane 95.0+%, TCI America™

CAS: 30736-07-3 Molecular Formula: C8H20Si MDL Number: MFCD00270996

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CAS	30736-07-3
MDL Number	MFCD00270996
Molecular Formula	C8H20Si

3,392

4-Nitro-D-phenylalanine Hydrate 97.0+%, TCI America™

CAS: 56613-61-7 Molecular Formula: C9H10N2O4 Molecular Weight (g/mol): 210.19 MDL Number: MFCD00150962 InChI Key: GTVVZTAFGPQSPC-UHFFFAOYNA-N Synonym: 4-nitro-d-phenylalanine,h-d-phe 4-no2-oh,p-nitro-d-phenylalanine,2r-2-amino-3-4-nitrophenyl propanoic acid,d-phenylalanine, 4-nitro,r-2-amino-3-4-nitrophenyl propanoic acid,d-4-nitrophe,ambotzhaa1044,pubchem13021,d-4-nitro phenylalanine PubChem CID: 679497 IUPAC Name: 2-amino-3-(4-nitrophenyl)propanoic acid SMILES: NC(CC1=CC=C(C=C1)[N+]([O-])=O)C(O)=O

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Specifications

PubChem CID	679497
CAS	56613-61-7
Molecular Weight (g/mol)	210.19
MDL Number	MFCD00150962
SMILES	NC(CC1=CC=C(C=C1)[N+]([O-])=O)C(O)=O
Synonym	4-nitro-d-phenylalanine,h-d-phe 4-no2-oh,p-nitro-d-phenylalanine,2r-2-amino-3-4-nitrophenyl propanoic acid,d-phenylalanine, 4-nitro,r-2-amino-3-4-nitrophenyl propanoic acid,d-4-nitrophe,ambotzhaa1044,pubchem13021,d-4-nitro phenylalanine
IUPAC Name	2-amino-3-(4-nitrophenyl)propanoic acid
InChI Key	GTVVZTAFGPQSPC-UHFFFAOYNA-N
Molecular Formula	C9H10N2O4

3,393

2-Allylcyclohexanone 97.0+%, TCI America™

CAS: 94-66-6 Molecular Formula: C9H14O Molecular Weight (g/mol): 138.21 MDL Number: MFCD00043548 InChI Key: UPGHEUSRLZSXAE-UHFFFAOYNA-N Synonym: 2-allylcyclohexanone,cyclohexanone, 2-2-propenyl,2-allylcyclohexan-1-one,cyclohexanone, 2-allyl,2-2-propenyl cyclohexanone,cyclohexanone, 2-2-propen-1-yl,2-prop-2-en-1-yl cyclohexan-1-one,2-allyl cyclohexanone,2-allyl-cyclohexanone,2-allyl-cyclohexan-1-one PubChem CID: 78944 IUPAC Name: 2-(prop-2-en-1-yl)cyclohexan-1-one SMILES: C=CCC1CCCCC1=O

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PubChem CID	78944
CAS	94-66-6
Molecular Weight (g/mol)	138.21
MDL Number	MFCD00043548
SMILES	C=CCC1CCCCC1=O
Synonym	2-allylcyclohexanone,cyclohexanone, 2-2-propenyl,2-allylcyclohexan-1-one,cyclohexanone, 2-allyl,2-2-propenyl cyclohexanone,cyclohexanone, 2-2-propen-1-yl,2-prop-2-en-1-yl cyclohexan-1-one,2-allyl cyclohexanone,2-allyl-cyclohexanone,2-allyl-cyclohexan-1-one
IUPAC Name	2-(prop-2-en-1-yl)cyclohexan-1-one
InChI Key	UPGHEUSRLZSXAE-UHFFFAOYNA-N
Molecular Formula	C9H14O

3,394

Stevioside 85.0+%, TCI America™

CAS: 57817-89-7 Molecular Formula: C38H60O18 Molecular Weight (g/mol): 804.88 MDL Number: MFCD00079561 InChI Key: UEDUENGHJMELGK-PEKONUEISA-N Synonym: stevioside PubChem CID: 134129657 SMILES: CC12CCCC(C1CCC34C2CCC(C3)(C(=C)C4)OC5C(C(C(C(O5)CO)O)O)OC6C(C(C(C(O6)CO)O)O)O)(C)C(=O)OC7C(C(C(C(O7)CO)O)O)O

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Specifications

PubChem CID	134129657
CAS	57817-89-7
Molecular Weight (g/mol)	804.88
MDL Number	MFCD00079561
SMILES	CC12CCCC(C1CCC34C2CCC(C3)(C(=C)C4)OC5C(C(C(C(O5)CO)O)O)OC6C(C(C(C(O6)CO)O)O)O)(C)C(=O)OC7C(C(C(C(O7)CO)O)O)O
Synonym	stevioside
InChI Key	UEDUENGHJMELGK-PEKONUEISA-N
Molecular Formula	C38H60O18

3,395

2,6-Dimethyloctane 90.0+%, TCI America™

CAS: 2051-30-1 Molecular Formula: C10H22 Molecular Weight (g/mol): 142.286 MDL Number: MFCD00042892 InChI Key: ZALHPSXXQIPKTQ-UHFFFAOYSA-N PubChem CID: 16319 IUPAC Name: 2,6-dimethyloctane SMILES: CCC(C)CCCC(C)C

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Specifications

PubChem CID	16319
CAS	2051-30-1
Molecular Weight (g/mol)	142.286
MDL Number	MFCD00042892
SMILES	CCC(C)CCCC(C)C
IUPAC Name	2,6-dimethyloctane
InChI Key	ZALHPSXXQIPKTQ-UHFFFAOYSA-N
Molecular Formula	C10H22

3,396

Diisononyl Cyclohexanedicarboxylate (mixture of isomers), TCI America™

CAS: 508181-38-2 Molecular Formula: C78H144O12 Molecular Weight (g/mol): 1274.00 MDL Number: MFCD28100825 InChI Key: QSNOUBLJFWGBSD-UHFFFAOYNA-N Synonym: Cyclohexanedicarboxylic Acid Diisononyl Ester PubChem CID: 131674806 IUPAC Name: 1,2-bis(3,5,5-trimethylhexyl) cyclohexane-1,2-dicarboxylate; 1,3-bis(3,5,5-trimethylhexyl) cyclohexane-1,3-dicarboxylate; 1,4-bis(3,5,5-trimethylhexyl) cyclohexane-1,4-dicarboxylate SMILES: CC(CCOC(=O)C1CCC(CC1)C(=O)OCCC(C)CC(C)(C)C)CC(C)(C)C.CC(CCOC(=O)C1CCCC(C1)C(=O)OCCC(C)CC(C)(C)C)CC(C)(C)C.CC(CCOC(=O)C1CCCCC1C(=O)OCCC(C)CC(C)(C)C)CC(C)(C)C

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Specifications

PubChem CID	131674806
CAS	508181-38-2
Molecular Weight (g/mol)	1274.00
MDL Number	MFCD28100825
SMILES	CC(CCOC(=O)C1CCC(CC1)C(=O)OCCC(C)CC(C)(C)C)CC(C)(C)C.CC(CCOC(=O)C1CCCC(C1)C(=O)OCCC(C)CC(C)(C)C)CC(C)(C)C.CC(CCOC(=O)C1CCCCC1C(=O)OCCC(C)CC(C)(C)C)CC(C)(C)C
Synonym	Cyclohexanedicarboxylic Acid Diisononyl Ester
IUPAC Name	1,2-bis(3,5,5-trimethylhexyl) cyclohexane-1,2-dicarboxylate; 1,3-bis(3,5,5-trimethylhexyl) cyclohexane-1,3-dicarboxylate; 1,4-bis(3,5,5-trimethylhexyl) cyclohexane-1,4-dicarboxylate
InChI Key	QSNOUBLJFWGBSD-UHFFFAOYNA-N
Molecular Formula	C78H144O12

3,397

2,5-Diphenylfuran 98.0+%, TCI America™

CAS: 955-83-9 Molecular Formula: C16H12O Molecular Weight (g/mol): 220.27 MDL Number: MFCD00037353 InChI Key: VUPDHIIPAKIKAB-UHFFFAOYSA-N PubChem CID: 70387 ChEBI: CHEBI:50459 IUPAC Name: 2,5-diphenylfuran SMILES: O1C(=CC=C1C1=CC=CC=C1)C1=CC=CC=C1

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Specifications

PubChem CID	70387
CAS	955-83-9
Molecular Weight (g/mol)	220.27
ChEBI	CHEBI:50459
MDL Number	MFCD00037353
SMILES	O1C(=CC=C1C1=CC=CC=C1)C1=CC=CC=C1
IUPAC Name	2,5-diphenylfuran
InChI Key	VUPDHIIPAKIKAB-UHFFFAOYSA-N
Molecular Formula	C16H12O

3,398

Arsenazo I Hydrate 90.0+%, TCI America™

CAS: 3547-38-4 Molecular Formula: C16H13AsN2Na2O11S2 Molecular Weight (g/mol): 594.304 MDL Number: MFCD00066725 InChI Key: HLLSKRQLMZTAFK-AXHWYJOWSA-N Synonym: 2-Arsonophenylazochromotropic Acid Sodium Salt, 2-(1,8-Dihydroxy-3,6-disulfo-2-naphthylazo)benzenearsonic Acid Sodium Salt, Neothorin PubChem CID: 131878335 IUPAC Name: (3E)-3-[(2-arsonophenyl)hydrazinylidene]-5-hydroxy-4-oxonaphthalene-2,7-disulfonic acid;sodium SMILES: C1=CC=C(C(=C1)NN=C2C(=CC3=CC(=CC(=C3C2=O)O)S(=O)(=O)O)S(=O)(=O)O)[As](=O)(O)O.[Na].[Na]

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Specifications

PubChem CID	131878335
CAS	3547-38-4
Molecular Weight (g/mol)	594.304
MDL Number	MFCD00066725
SMILES	C1=CC=C(C(=C1)NN=C2C(=CC3=CC(=CC(=C3C2=O)O)S(=O)(=O)O)S(=O)(=O)O)[As](=O)(O)O.[Na].[Na]
Synonym	2-Arsonophenylazochromotropic Acid Sodium Salt, 2-(1,8-Dihydroxy-3,6-disulfo-2-naphthylazo)benzenearsonic Acid Sodium Salt, Neothorin
IUPAC Name	(3E)-3-[(2-arsonophenyl)hydrazinylidene]-5-hydroxy-4-oxonaphthalene-2,7-disulfonic acid;sodium
InChI Key	HLLSKRQLMZTAFK-AXHWYJOWSA-N
Molecular Formula	C16H13AsN2Na2O11S2

3,399

N-(2,6-Dimethylphenylcarbamoylmethyl)iminodiacetic Acid 98.0+%, TCI America™

CAS: 59160-29-1 Molecular Formula: C14H18N2O5 Molecular Weight (g/mol): 294.31 MDL Number: MFCD00038399 InChI Key: DJQJFMSHHYAZJD-UHFFFAOYSA-N Synonym: N-(2,6-Xylidinocarbonylmethyl)iminodiacetic Acid PubChem CID: 42963 IUPAC Name: 2-[(carboxymethyl)({[(2,6-dimethylphenyl)carbamoyl]methyl})amino]acetic acid SMILES: CC1=CC=CC(C)=C1NC(=O)CN(CC(O)=O)CC(O)=O

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Specifications

PubChem CID	42963
CAS	59160-29-1
Molecular Weight (g/mol)	294.31
MDL Number	MFCD00038399
SMILES	CC1=CC=CC(C)=C1NC(=O)CN(CC(O)=O)CC(O)=O
Synonym	N-(2,6-Xylidinocarbonylmethyl)iminodiacetic Acid
IUPAC Name	2-[(carboxymethyl)({[(2,6-dimethylphenyl)carbamoyl]methyl})amino]acetic acid
InChI Key	DJQJFMSHHYAZJD-UHFFFAOYSA-N
Molecular Formula	C14H18N2O5

3,400

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

3,401

Diethylbenzene (mixture) 70.0+%, TCI America™

CAS: 25340-17-4 Molecular Formula: C10H14 MDL Number: MFCD00792900

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Specifications

CAS	25340-17-4
MDL Number	MFCD00792900
Molecular Formula	C10H14

3,402

trans-1,3-Dimethylcyclohexane 95.0+%, TCI America™

CAS: 2207-03-6 Molecular Formula: C8H16 Molecular Weight (g/mol): 112.22 MDL Number: MFCD00064953 InChI Key: SGVUHPSBDNVHKL-YUMQZZPRSA-N Synonym: trans-1,3-dimethylcyclohexane,1r,3r-1,3-dimethylcyclohexane,cyclohexane, 1,3-dimethyl-, trans,1,trans-3-dimethylcyclohexane,trans-hexahydro-m-xylene,1,3-dimethylcyclohexane, trans,1,3-dimethyl trans-cyclohexane,cyclohexane, trans-1,3-dimethyl,+/--trans-1,3-dimethylcyclohexane PubChem CID: 252362 IUPAC Name: (1S,3S)-1,3-dimethylcyclohexane SMILES: CC1CCCC(C1)C

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PubChem CID	252362
CAS	2207-03-6
Molecular Weight (g/mol)	112.22
MDL Number	MFCD00064953
SMILES	CC1CCCC(C1)C
Synonym	trans-1,3-dimethylcyclohexane,1r,3r-1,3-dimethylcyclohexane,cyclohexane, 1,3-dimethyl-, trans,1,trans-3-dimethylcyclohexane,trans-hexahydro-m-xylene,1,3-dimethylcyclohexane, trans,1,3-dimethyl trans-cyclohexane,cyclohexane, trans-1,3-dimethyl,+/--trans-1,3-dimethylcyclohexane
IUPAC Name	(1S,3S)-1,3-dimethylcyclohexane
InChI Key	SGVUHPSBDNVHKL-YUMQZZPRSA-N
Molecular Formula	C8H16

3,403

Di-tert-butyl Azodicarboxylate (20% in Toluene), TCI America™

CAS: 870-50-8 Molecular Formula: C10H18N2O4 Molecular Weight (g/mol): 230.264 MDL Number: MFCD00015001 InChI Key: QKSQWQOAUQFORH-VAWYXSNFSA-N Synonym: di-tert-butyl azodicarboxylate,di-tert-butylazodicarboxylate,di-tert-butyl diazene-1,2-dicarboxylate,azodicarboxylic acid di-tert-butyl ester,di-tert-butyl azodicarboxylate dbad,pubchem17548,n-tert-butoxycarbonyl imino tert-butoxy formamide,tert-butyl tert-butyl oxycarbonyl diazenyl formate,n-tert-butoxy carbonyl imino tert-butoxy formamide,1,2-diazenedicarboxylic acid, 1,2-bis 1,1-dimethylethyl ester PubChem CID: 6034084 IUPAC Name: tert-butyl (NE)-N-[(2-methylpropan-2-yl)oxycarbonylimino]carbamate SMILES: CC(C)(C)OC(=O)N=NC(=O)OC(C)(C)C

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Specifications

PubChem CID	6034084
CAS	870-50-8
Molecular Weight (g/mol)	230.264
MDL Number	MFCD00015001
SMILES	CC(C)(C)OC(=O)N=NC(=O)OC(C)(C)C
Synonym	di-tert-butyl azodicarboxylate,di-tert-butylazodicarboxylate,di-tert-butyl diazene-1,2-dicarboxylate,azodicarboxylic acid di-tert-butyl ester,di-tert-butyl azodicarboxylate dbad,pubchem17548,n-tert-butoxycarbonyl imino tert-butoxy formamide,tert-butyl tert-butyl oxycarbonyl diazenyl formate,n-tert-butoxy carbonyl imino tert-butoxy formamide,1,2-diazenedicarboxylic acid, 1,2-bis 1,1-dimethylethyl ester
IUPAC Name	tert-butyl (NE)-N-[(2-methylpropan-2-yl)oxycarbonylimino]carbamate
InChI Key	QKSQWQOAUQFORH-VAWYXSNFSA-N
Molecular Formula	C10H18N2O4

3,404

Nonane 99.5+%, TCI America™

CAS: 111-84-2 Molecular Formula: C9H20 Molecular Weight (g/mol): 128.259 MDL Number: MFCD00009574 InChI Key: BKIMMITUMNQMOS-UHFFFAOYSA-N Synonym: n-nonane,shellsol 140,nonyl hydride,nonan,heptane, ethyl,unii-t9w3vh6g10,ccris 6081,hsdb 107,dsstox_cid_5796,nonane, analytical standard PubChem CID: 8141 ChEBI: CHEBI:32892 IUPAC Name: nonane SMILES: CCCCCCCCC

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Specifications

PubChem CID	8141
CAS	111-84-2
Molecular Weight (g/mol)	128.259
ChEBI	CHEBI:32892
MDL Number	MFCD00009574
SMILES	CCCCCCCCC
Synonym	n-nonane,shellsol 140,nonyl hydride,nonan,heptane, ethyl,unii-t9w3vh6g10,ccris 6081,hsdb 107,dsstox_cid_5796,nonane, analytical standard
IUPAC Name	nonane
InChI Key	BKIMMITUMNQMOS-UHFFFAOYSA-N
Molecular Formula	C9H20

3,405

Tridecane 99.5+%, TCI America™

CAS: 629-50-5 Molecular Formula: C13H28 Molecular Weight (g/mol): 184.37 MDL Number: MFCD00008979 InChI Key: IIYFAKIEWZDVMP-UHFFFAOYSA-N Synonym: n-tridecane,tridekan,alkanes, c12-14,dodecane, methyl,unii-a3lzf0l939,tridecane, n,trd,tridecane, analytical standard,tridecan,tridecyl group PubChem CID: 12388 ChEBI: CHEBI:35998 IUPAC Name: tridecane SMILES: CCCCCCCCCCCCC

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Specifications

PubChem CID	12388
CAS	629-50-5
Molecular Weight (g/mol)	184.37
ChEBI	CHEBI:35998
MDL Number	MFCD00008979
SMILES	CCCCCCCCCCCCC
Synonym	n-tridecane,tridekan,alkanes, c12-14,dodecane, methyl,unii-a3lzf0l939,tridecane, n,trd,tridecane, analytical standard,tridecan,tridecyl group
IUPAC Name	tridecane
InChI Key	IIYFAKIEWZDVMP-UHFFFAOYSA-N
Molecular Formula	C13H28

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