Unclassified Organic Compounds

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

151 – 165 of 176,964 results

151

Dipropylene glycol monobutyl ether

CAS: 29911-28-2 Molecular Formula: C10H22O3 Molecular Weight (g/mol): 190.28 InChI Key: CUVLMZNMSPJDON-UHFFFAOYNA-N IUPAC Name: 1-[(1-butoxypropan-2-yl)oxy]propan-2-ol SMILES: CCCCOCC(C)OCC(C)O

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Specifications

CAS	29911-28-2
Molecular Weight (g/mol)	190.28
SMILES	CCCCOCC(C)OCC(C)O
IUPAC Name	1-[(1-butoxypropan-2-yl)oxy]propan-2-ol
InChI Key	CUVLMZNMSPJDON-UHFFFAOYNA-N
Molecular Formula	C10H22O3

152

E-64

CAS: 66701-25-5 Molecular Formula: C15H27N5O5 Molecular Weight (g/mol): 357.41 MDL Number: MFCD00080261,MFCD00080261 InChI Key: LTLYEAJONXGNFG-HBNTYKKESA-N Synonym: d09fgq,l-3-trans-carboxy-oxiran-2-carbonyl-leu-agmatin,trans-epoxysuccinyl-leucylamido-4-guanidino butane,3-1-4-carbamimidamidobutyl carbamoyl-3-methylbutyl carbamoyl oxirane-2-carboxylic acid,3-1-4-diaminomethylideneamino butylamino-4-methyl-1-oxopentan-2-yl carbamoyl oxirane-2-carboxylic acid PubChem CID: 4641099 IUPAC Name: 3-[[1-[4-(diaminomethylideneamino)butylamino]-4-methyl-1-oxopentan-2-yl]carbamoyl]oxirane-2-carboxylic acid SMILES: CC(C)C[C@H](NC(=O)[C@@H]1O[C@H]1C(O)=O)C(=O)NCCCCN=C(N)N

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Specifications

PubChem CID	4641099
CAS	66701-25-5
Molecular Weight (g/mol)	357.41
MDL Number	MFCD00080261,MFCD00080261
SMILES	CC(C)C[C@H](NC(=O)[C@@H]1O[C@H]1C(O)=O)C(=O)NCCCCN=C(N)N
Synonym	d09fgq,l-3-trans-carboxy-oxiran-2-carbonyl-leu-agmatin,trans-epoxysuccinyl-leucylamido-4-guanidino butane,3-1-4-carbamimidamidobutyl carbamoyl-3-methylbutyl carbamoyl oxirane-2-carboxylic acid,3-1-4-diaminomethylideneamino butylamino-4-methyl-1-oxopentan-2-yl carbamoyl oxirane-2-carboxylic acid
IUPAC Name	3-[[1-[4-(diaminomethylideneamino)butylamino]-4-methyl-1-oxopentan-2-yl]carbamoyl]oxirane-2-carboxylic acid
InChI Key	LTLYEAJONXGNFG-HBNTYKKESA-N
Molecular Formula	C15H27N5O5

153

Creatine phosphate disodium salt tetrahydrate, 99%

CAS: 71519-72-7 Molecular Formula: C4H8N3Na2O5P Molecular Weight (g/mol): 255.08 MDL Number: MFCD00150192 InChI Key: RNTXMYSPASRLFT-UHFFFAOYSA-L Synonym: creatine phosphate sodium salt PubChem CID: 91884830 SMILES: [Na+].[Na+].CN(CC(O)=O)C(N)=NP([O-])([O-])=O

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Specifications

PubChem CID	91884830
CAS	71519-72-7
Molecular Weight (g/mol)	255.08
MDL Number	MFCD00150192
SMILES	[Na+].[Na+].CN(CC(O)=O)C(N)=NP([O-])([O-])=O
Synonym	creatine phosphate sodium salt
InChI Key	RNTXMYSPASRLFT-UHFFFAOYSA-L
Molecular Formula	C4H8N3Na2O5P

154

Gellan Gum

CAS: 71010-52-1 Molecular Formula: (C24H38O20)A MDL Number: MFCD00131909 Synonym: Phytagel

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Specifications

CAS	71010-52-1
MDL Number	MFCD00131909
Synonym	Phytagel
Molecular Formula	(C24H38O20)A

155

N-Lauroylsarcosine sodium salt, ultrapure, 97%, Thermo Scientific Chemicals

CAS: 137-16-6 Molecular Formula: C15H28NNaO3 Molecular Weight (g/mol): 293.38 MDL Number: MFCD00042728 InChI Key: KSAVQLQVUXSOCR-UHFFFAOYSA-M Synonym: sarkosyl nl,sodium lauroyl sarcosinate,n-lauroylsarcosine sodium salt,sodium n-lauroylsarcosinate,sodium lauroylsarcosinate,sarcosyl nl,maprosyl 30,compound 105,gardol,hamposyl l-30 PubChem CID: 23668817 SMILES: [Na+].CCCCCCCCCCCC(=O)N(C)CC([O-])=O

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Specifications

PubChem CID	23668817
CAS	137-16-6
Molecular Weight (g/mol)	293.38
MDL Number	MFCD00042728
SMILES	[Na+].CCCCCCCCCCCC(=O)N(C)CC([O-])=O
Synonym	sarkosyl nl,sodium lauroyl sarcosinate,n-lauroylsarcosine sodium salt,sodium n-lauroylsarcosinate,sodium lauroylsarcosinate,sarcosyl nl,maprosyl 30,compound 105,gardol,hamposyl l-30
InChI Key	KSAVQLQVUXSOCR-UHFFFAOYSA-M
Molecular Formula	C15H28NNaO3

156

2,2'-Azobis(2-methylpropionamidine) dihydrochloride, 98%

CAS: 2997-92-4 Molecular Formula: C₈H₁₈N₆·₂HCl Molecular Weight (g/mol): 271.19 MDL Number: MFCD00142725 InChI Key: LXEKPEMOWBOYRF-UHFFFAOYSA-N Synonym: aaph,2,2'-diazene-1,2-diyl bis 2-methylpropanimidamide dihydrochloride,2,2'-azobis 2-methylpropionamidine dihydrochloride,ms 1 catalyst,2,2'-azobis 2-amidinopropane dihydrochloride,unii-7381jdr72f,ccris 7279,ms 1,propanimidamide, 2,2'-azobis 2-methyl-, dihydrochloride,abap PubChem CID: 76344 IUPAC Name: 2-[(1-amino-1-imino-2-methylpropan-2-yl)diazenyl]-2-methylpropanimidamide;dihydrochloride SMILES: CC(C)(C(=N)N)N=NC(C)(C)C(=N)N.Cl.Cl

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Specifications

PubChem CID	76344
CAS	2997-92-4
Molecular Weight (g/mol)	271.19
MDL Number	MFCD00142725
SMILES	CC(C)(C(=N)N)N=NC(C)(C)C(=N)N.Cl.Cl
Synonym	aaph,2,2'-diazene-1,2-diyl bis 2-methylpropanimidamide dihydrochloride,2,2'-azobis 2-methylpropionamidine dihydrochloride,ms 1 catalyst,2,2'-azobis 2-amidinopropane dihydrochloride,unii-7381jdr72f,ccris 7279,ms 1,propanimidamide, 2,2'-azobis 2-methyl-, dihydrochloride,abap
IUPAC Name	2-[(1-amino-1-imino-2-methylpropan-2-yl)diazenyl]-2-methylpropanimidamide;dihydrochloride
InChI Key	LXEKPEMOWBOYRF-UHFFFAOYSA-N
Molecular Formula	C₈H₁₈N₆·₂HCl

157

Boron trifluoride-tetrahydrofuran complex, BF{3} 45.5%

CAS: 462-34-0 Molecular Formula: C4H8BF3O Molecular Weight (g/mol): 139.91 MDL Number: MFCD00040372 InChI Key: CHNLPLHJUPMEOI-UHFFFAOYSA-N Synonym: boron trifluoride tetrahydrofuran complex,trifluoro tetrahydro-1h-furan-1-ium-1-yl borate,pubchem7062,trifluoro oxolan-1-ium-1-yl boranuide,borontrifluoride tetrahydrofuran complex,boron trifluoride tetrahydrofuran complex, contains sulfur dioxide as peroxide formation suppressor PubChem CID: 60146129 SMILES: FB(F)F.C1CCOC1

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Specifications

PubChem CID	60146129
CAS	462-34-0
Molecular Weight (g/mol)	139.91
MDL Number	MFCD00040372
SMILES	FB(F)F.C1CCOC1
Synonym	boron trifluoride tetrahydrofuran complex,trifluoro tetrahydro-1h-furan-1-ium-1-yl borate,pubchem7062,trifluoro oxolan-1-ium-1-yl boranuide,borontrifluoride tetrahydrofuran complex,boron trifluoride tetrahydrofuran complex, contains sulfur dioxide as peroxide formation suppressor
InChI Key	CHNLPLHJUPMEOI-UHFFFAOYSA-N
Molecular Formula	C4H8BF3O

158

Thermo Scientific Chemicals Sarcosine, 98%

CAS: 107-97-1 Molecular Formula: C3H7NO2 Molecular Weight (g/mol): 89.09 MDL Number: MFCD00004279 InChI Key: FSYKKLYZXJSNPZ-UHFFFAOYSA-N Synonym: sarcosine,n-methylglycine,sarcosinic acid,methylglycine,glycine, n-methyl,methylaminoacetic acid,n-methylaminoacetic acid,sarcosin,2-methylamino acetic acid,methylamino acetic acid PubChem CID: 1088 ChEBI: CHEBI:15611 IUPAC Name: 2-(methylamino)acetic acid SMILES: CNCC(O)=O

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Specifications

PubChem CID	1088
CAS	107-97-1
Molecular Weight (g/mol)	89.09
ChEBI	CHEBI:15611
MDL Number	MFCD00004279
SMILES	CNCC(O)=O
Synonym	sarcosine,n-methylglycine,sarcosinic acid,methylglycine,glycine, n-methyl,methylaminoacetic acid,n-methylaminoacetic acid,sarcosin,2-methylamino acetic acid,methylamino acetic acid
IUPAC Name	2-(methylamino)acetic acid
InChI Key	FSYKKLYZXJSNPZ-UHFFFAOYSA-N
Molecular Formula	C3H7NO2

159

L-Theanine, 98%

CAS: 3081-61-6 Molecular Formula: C7H14N2O3 Molecular Weight (g/mol): 174.20 MDL Number: MFCD00059653 InChI Key: DATAGRPVKZEWHA-UHFFFAOYNA-N Synonym: l-theanine,theanine,theanin,s-2-amino-5-ethylamino-5-oxopentanoic acid,n-ethyl-l-glutamine,suntheanine,n5-ethyl-l-glutamine,n 5-ethyl-l-glutamine,unii-8021pr16qo PubChem CID: 439378 ChEBI: CHEBI:17394 IUPAC Name: (2S)-2-amino-5-(ethylamino)-5-oxopentanoic acid SMILES: CCNC(=O)CCC(N)C(O)=O

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Specifications

PubChem CID	439378
CAS	3081-61-6
Molecular Weight (g/mol)	174.20
ChEBI	CHEBI:17394
MDL Number	MFCD00059653
SMILES	CCNC(=O)CCC(N)C(O)=O
Synonym	l-theanine,theanine,theanin,s-2-amino-5-ethylamino-5-oxopentanoic acid,n-ethyl-l-glutamine,suntheanine,n5-ethyl-l-glutamine,n 5-ethyl-l-glutamine,unii-8021pr16qo
IUPAC Name	(2S)-2-amino-5-(ethylamino)-5-oxopentanoic acid
InChI Key	DATAGRPVKZEWHA-UHFFFAOYNA-N
Molecular Formula	C7H14N2O3

160

L(+)-Penicillamine, 98%

CAS: 1113-41-3 Molecular Formula: C₅H₁₁NO₂S Molecular Weight (g/mol): 149.21 MDL Number: MFCD00064303 InChI Key: VVNCNSJFMMFHPL-GSVOUGTGSA-N Synonym: l-penicillamine,3-mercapto-l-valine,penicillamine l-form,l-+-beta-mercaptovaline,l-pen,2r-2-amino-3-methyl-3-sulfanylbutanoic acid,3-sulfanyl-l-valine,h-pen-oh,unii-no1yib7oig,3,3-dimethyl-l-cysteine PubChem CID: 92863 ChEBI: CHEBI:50869 IUPAC Name: (2R)-2-amino-3-methyl-3-sulfanylbutanoic acid SMILES: CC(C)(C(C(=O)O)N)S

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Specifications

PubChem CID	92863
CAS	1113-41-3
Molecular Weight (g/mol)	149.21
ChEBI	CHEBI:50869
MDL Number	MFCD00064303
SMILES	CC(C)(C(C(=O)O)N)S
Synonym	l-penicillamine,3-mercapto-l-valine,penicillamine l-form,l-+-beta-mercaptovaline,l-pen,2r-2-amino-3-methyl-3-sulfanylbutanoic acid,3-sulfanyl-l-valine,h-pen-oh,unii-no1yib7oig,3,3-dimethyl-l-cysteine
IUPAC Name	(2R)-2-amino-3-methyl-3-sulfanylbutanoic acid
InChI Key	VVNCNSJFMMFHPL-GSVOUGTGSA-N
Molecular Formula	C₅H₁₁NO₂S

161

Digitonin

CAS: 11024-24-1 Molecular Formula: C56H92O29 Molecular Weight (g/mol): 1229.32 MDL Number: MFCD00077729 InChI Key: UVYVLBIGDKGWPX-QYLWGQLPSA-N Synonym: digitonin PubChem CID: 102004607 IUPAC Name: (2S,3R,4S,5S,6R)-2-{[(2S,3R,4S,5S,6R)-2-{[(2S,3R,4S,5R,6R)-2-{[(2R,3R,4R,5R,6R)-4,5-dihydroxy-2-(hydroxymethyl)-6-[(1'R,2R,2'S,3'S,4'R,7'S,8'R,9'S,12'S,13'S,15'R,16'R,18'S)-5,7',9',13'-tetramethyl-5'-oxaspiro[oxane-2,6'-pentacyclo[10.8.0.0²,⁹.0⁴,⁸.0¹³,¹⁸]icosane]-3',15'-dioloxy]oxan-3-yl]oxy}-5-hydroxy-6-(hydroxymethyl)-4-{[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxy}oxan-3-yl]oxy}-3,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triol SMILES: C[C@H]1[C@H]2[C@@H](O[C@]11CCC(C)CO1)[C@@H](O)[C@H]1[C@@H]3CC[C@H]4C[C@@H](O[C@@H]5O[C@H](CO)[C@H](O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O[C@@H]7OC[C@@H](O)[C@H](O)[C@H]7O)[C@H]6O[C@@H]6O[C@H](CO)[C@H](O)[C@H](O[C@@H]7O[C@H](CO)[C@@H](O)[C@H](O)[C@H]7O)[C@H]6O)[C@H](O)[C@H]5O)[C@H](O)C[C@]4(C)[C@H]3CC[C@]21C

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Specifications

PubChem CID	102004607
CAS	11024-24-1
Molecular Weight (g/mol)	1229.32
MDL Number	MFCD00077729
SMILES	C[C@H]1[C@H]2[C@@H](O[C@]11CCC(C)CO1)[C@@H](O)[C@H]1[C@@H]3CC[C@H]4C[C@@H](O[C@@H]5O[C@H](CO)[C@H](O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O[C@@H]7OC[C@@H](O)[C@H](O)[C@H]7O)[C@H]6O[C@@H]6O[C@H](CO)[C@H](O)[C@H](O[C@@H]7O[C@H](CO)[C@@H](O)[C@H](O)[C@H]7O)[C@H]6O)[C@H](O)[C@H]5O)[C@H](O)C[C@]4(C)[C@H]3CC[C@]21C
Synonym	digitonin
IUPAC Name	(2S,3R,4S,5S,6R)-2-{[(2S,3R,4S,5S,6R)-2-{[(2S,3R,4S,5R,6R)-2-{[(2R,3R,4R,5R,6R)-4,5-dihydroxy-2-(hydroxymethyl)-6-[(1'R,2R,2'S,3'S,4'R,7'S,8'R,9'S,12'S,13'S,15'R,16'R,18'S)-5,7',9',13'-tetramethyl-5'-oxaspiro[oxane-2,6'-pentacyclo[10.8.0.0²,⁹.0⁴,⁸.0¹³,¹⁸]icosane]-3',15'-dioloxy]oxan-3-yl]oxy}-5-hydroxy-6-(hydroxymethyl)-4-{[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxy}oxan-3-yl]oxy}-3,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triol
InChI Key	UVYVLBIGDKGWPX-QYLWGQLPSA-N
Molecular Formula	C56H92O29

162

Poly(propylene glycol) bis(2-aminopropyl ether), Mn ca 230

CAS: 9046-10-0 Molecular Formula: C4H9NO2 Molecular Weight (g/mol): 103.12 InChI Key: JCZPOYAMKJFOLA-UHFFFAOYNA-N Synonym: 3,4-pyrrolidinediol,3,4-dihydroxy-2h-pyrroline,polyetheramine d 230,polyetheramine d 2000,poly propylene glycol bis 2-aminopropyl ether,poly propylene oxide , diamine terminated,o,o'-bis 2-aminopropyl polypropyleneglycol,o,o'-bis 2-aminopropyl polypropylene glycol 300,polypropylene glycol 130 bis 2-aminopropyl ether,polypropylene glycol 300 bis 2-aminopropyl ether PubChem CID: 13329881 IUPAC Name: pyrrolidine-3,4-diol SMILES: OC1CNCC1O

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Specifications

PubChem CID	13329881
CAS	9046-10-0
Molecular Weight (g/mol)	103.12
SMILES	OC1CNCC1O
Synonym	3,4-pyrrolidinediol,3,4-dihydroxy-2h-pyrroline,polyetheramine d 230,polyetheramine d 2000,poly propylene glycol bis 2-aminopropyl ether,poly propylene oxide , diamine terminated,o,o'-bis 2-aminopropyl polypropyleneglycol,o,o'-bis 2-aminopropyl polypropylene glycol 300,polypropylene glycol 130 bis 2-aminopropyl ether,polypropylene glycol 300 bis 2-aminopropyl ether
IUPAC Name	pyrrolidine-3,4-diol
InChI Key	JCZPOYAMKJFOLA-UHFFFAOYNA-N
Molecular Formula	C4H9NO2