Phenylpropanes

Organic compound that contain a propane chain with a phenyl substitution in the following structure: C₆H₅CH₂CH2CH3. These compounds are considered hydrocarbons.

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226 – 240 of 707 results

226

(1S,2R)-2-(Dibutylamino)-1-phenyl-1-propanol 98.0+%, TCI America™

CAS: 114389-70-7 Molecular Formula: C17H29NO Molecular Weight (g/mol): 263.425 MDL Number: MFCD00142695 InChI Key: BRRGNOFUBFINSX-NVXWUHKLSA-N Synonym: (-)-alpha-[1-(Dibutylamino)ethyl]benzyl Alcohol, (-)-N,N-Dibutylnorephedrin PubChem CID: 11003877 IUPAC Name: (1S,2R)-2-(dibutylamino)-1-phenylpropan-1-ol SMILES: CCCCN(CCCC)C(C)C(C1=CC=CC=C1)O

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PubChem CID	11003877
CAS	114389-70-7
Molecular Weight (g/mol)	263.425
MDL Number	MFCD00142695
SMILES	CCCCN(CCCC)C(C)C(C1=CC=CC=C1)O
Synonym	(-)-alpha-[1-(Dibutylamino)ethyl]benzyl Alcohol, (-)-N,N-Dibutylnorephedrin
IUPAC Name	(1S,2R)-2-(dibutylamino)-1-phenylpropan-1-ol
InChI Key	BRRGNOFUBFINSX-NVXWUHKLSA-N
Molecular Formula	C17H29NO

227

1,4-Di-tert-butylbenzene 99.0+%, TCI America™

CAS: 1012-72-2 Molecular Formula: C14H22 Molecular Weight (g/mol): 190.33 MDL Number: MFCD00008836 InChI Key: OOWNNCMFKFBNOF-UHFFFAOYSA-N Synonym: 1,4-di-tert-butylbenzene,p-di-tert-butylbenzene,benzene, p-di-tert-butyl,benzene, 1,4-bis 1,1-dimethylethyl,unii-55ptx4kh71,bis 1,1-dimethylethyl benzene,benzene, bis 1,1-dimethylethyl,1,4-di-t-butylbenzene,acmc-2097up,1,4-bis tert-butyl benzene PubChem CID: 13895 IUPAC Name: 1,4-ditert-butylbenzene SMILES: CC(C)(C)C1=CC=C(C=C1)C(C)(C)C

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PubChem CID	13895
CAS	1012-72-2
Molecular Weight (g/mol)	190.33
MDL Number	MFCD00008836
SMILES	CC(C)(C)C1=CC=C(C=C1)C(C)(C)C
Synonym	1,4-di-tert-butylbenzene,p-di-tert-butylbenzene,benzene, p-di-tert-butyl,benzene, 1,4-bis 1,1-dimethylethyl,unii-55ptx4kh71,bis 1,1-dimethylethyl benzene,benzene, bis 1,1-dimethylethyl,1,4-di-t-butylbenzene,acmc-2097up,1,4-bis tert-butyl benzene
IUPAC Name	1,4-ditert-butylbenzene
InChI Key	OOWNNCMFKFBNOF-UHFFFAOYSA-N
Molecular Formula	C14H22

228

6-tert-Butyl-o-cresol 99.0+%, TCI America™

CAS: 2219-82-1 Molecular Formula: C11H16O Molecular Weight (g/mol): 164.25 MDL Number: MFCD00002239 InChI Key: BKZXZGWHTRCFPX-UHFFFAOYSA-N Synonym: 2-tert-Butyl-6-methylphenol PubChem CID: 16678 IUPAC Name: 2-tert-butyl-6-methylphenol SMILES: CC1=CC=CC(=C1O)C(C)(C)C

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Specifications

PubChem CID	16678
CAS	2219-82-1
Molecular Weight (g/mol)	164.25
MDL Number	MFCD00002239
SMILES	CC1=CC=CC(=C1O)C(C)(C)C
Synonym	2-tert-Butyl-6-methylphenol
IUPAC Name	2-tert-butyl-6-methylphenol
InChI Key	BKZXZGWHTRCFPX-UHFFFAOYSA-N
Molecular Formula	C11H16O

229

2-Phenylisobutyric Acid 98.0+%, TCI America™

CAS: 826-55-1 Molecular Formula: C10H12O2 Molecular Weight (g/mol): 164.20 MDL Number: MFCD00014332 InChI Key: YYEROYLAYAVZNW-UHFFFAOYSA-N Synonym: 2-methyl-2-phenylpropionic acid,2-phenylisobutyric acid,alpha,alpha-dimethylphenylacetic acid,unii-dr8huh2gyk,dimethylphenylacetic acid,dr8huh2gyk,2-methyl-2-phenyl-propionic acid,hydratropic acid, .alpha.-methyl,benzeneacetic acid,.alpha.-dimethyl,propionic acid, 2-methyl-2-phenyl PubChem CID: 13222 IUPAC Name: 2-methyl-2-phenylpropanoic acid SMILES: CC(C)(C(O)=O)C1=CC=CC=C1

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Specifications

PubChem CID	13222
CAS	826-55-1
Molecular Weight (g/mol)	164.20
MDL Number	MFCD00014332
SMILES	CC(C)(C(O)=O)C1=CC=CC=C1
Synonym	2-methyl-2-phenylpropionic acid,2-phenylisobutyric acid,alpha,alpha-dimethylphenylacetic acid,unii-dr8huh2gyk,dimethylphenylacetic acid,dr8huh2gyk,2-methyl-2-phenyl-propionic acid,hydratropic acid, .alpha.-methyl,benzeneacetic acid,.alpha.-dimethyl,propionic acid, 2-methyl-2-phenyl
IUPAC Name	2-methyl-2-phenylpropanoic acid
InChI Key	YYEROYLAYAVZNW-UHFFFAOYSA-N
Molecular Formula	C10H12O2

230

2-(4-Chlorophenyl)-3-methylbutyric Acid 98.0+%, TCI America™

CAS: 2012-74-0 Molecular Formula: C11H13ClO2 Molecular Weight (g/mol): 212.67 MDL Number: MFCD04112625,MFCD11858304,MFCD00037763 InChI Key: VTJMSIIXXKNIDJ-UHFFFAOYNA-N PubChem CID: 16197 ChEBI: CHEBI:39345 IUPAC Name: 2-(4-chlorophenyl)-3-methylbutanoic acid SMILES: CC(C)C(C(O)=O)C1=CC=C(Cl)C=C1

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Specifications

PubChem CID	16197
CAS	2012-74-0
Molecular Weight (g/mol)	212.67
ChEBI	CHEBI:39345
MDL Number	MFCD04112625,MFCD11858304,MFCD00037763
SMILES	CC(C)C(C(O)=O)C1=CC=C(Cl)C=C1
IUPAC Name	2-(4-chlorophenyl)-3-methylbutanoic acid
InChI Key	VTJMSIIXXKNIDJ-UHFFFAOYNA-N
Molecular Formula	C11H13ClO2

231

4-tert-Butylphenylboronic Acid (contains varying amounts of Anhydride), TCI America™

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Specifications

PubChem CID	2734320
CAS	123324-71-0
MDL Number	MFCD01009697
Physical Form	Crystalline Powder
TSCA	No
IUPAC Name	(4-tert-butylphenyl)boronic acid
InChI Key	MNJYZNVROSZZQC-UHFFFAOYSA-N
Molecular Formula	C10H15BO2
Formula Weight	178.04
Melting Point	184°C

232

4-Chlorophenylacetone 97.0+%, TCI America™

CAS: 5586-88-9 Molecular Formula: C9H9ClO Molecular Weight (g/mol): 168.62 MDL Number: MFCD00045214 InChI Key: WEJRYKSUUFKMBC-UHFFFAOYSA-N Synonym: 4-chlorophenylacetone,1-4-chlorophenyl acetone,1-4-chlorophenyl propan-2-one,1-p-chlorophenyl acetone,1-4-chloro-phenyl-propan-2-one,p-chlorophenyl acetone,2-propanone, 1-4-chlorophenyl,p-chlorophenylacetone,4-chlorophenyl acetone PubChem CID: 79699 IUPAC Name: 1-(4-chlorophenyl)propan-2-one SMILES: CC(=O)CC1=CC=C(Cl)C=C1

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PubChem CID	79699
CAS	5586-88-9
Molecular Weight (g/mol)	168.62
MDL Number	MFCD00045214
SMILES	CC(=O)CC1=CC=C(Cl)C=C1
Synonym	4-chlorophenylacetone,1-4-chlorophenyl acetone,1-4-chlorophenyl propan-2-one,1-p-chlorophenyl acetone,1-4-chloro-phenyl-propan-2-one,p-chlorophenyl acetone,2-propanone, 1-4-chlorophenyl,p-chlorophenylacetone,4-chlorophenyl acetone
IUPAC Name	1-(4-chlorophenyl)propan-2-one
InChI Key	WEJRYKSUUFKMBC-UHFFFAOYSA-N
Molecular Formula	C9H9ClO

233

4-Isobutylbenzoic Acid 99.0+%, TCI America™

CAS: 38861-88-0 Molecular Formula: C11H14O2 Molecular Weight (g/mol): 178.23 MDL Number: MFCD00191658 InChI Key: VUBBCFWWSKOHTH-UHFFFAOYSA-N PubChem CID: 38111 IUPAC Name: 4-(2-methylpropyl)benzoic acid SMILES: CC(C)CC1=CC=C(C=C1)C(O)=O

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PubChem CID	38111
CAS	38861-88-0
Molecular Weight (g/mol)	178.23
MDL Number	MFCD00191658
SMILES	CC(C)CC1=CC=C(C=C1)C(O)=O
IUPAC Name	4-(2-methylpropyl)benzoic acid
InChI Key	VUBBCFWWSKOHTH-UHFFFAOYSA-N
Molecular Formula	C11H14O2

234

6-[2-Propyl-4-(4-pyridylazo)phenoxy]hexanoic Acid 98.0+%, TCI America™

CAS: 312694-02-3 Molecular Formula: C20H25N3O3 Molecular Weight (g/mol): 355.438 InChI Key: RKSDFQDWVOJLAU-UHFFFAOYSA-N PubChem CID: 44629824 IUPAC Name: 6-[2-propyl-4-(pyridin-4-yldiazenyl)phenoxy]hexanoic acid SMILES: CCCC1=C(C=CC(=C1)N=NC2=CC=NC=C2)OCCCCCC(=O)O

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Specifications

PubChem CID	44629824
CAS	312694-02-3
Molecular Weight (g/mol)	355.438
SMILES	CCCC1=C(C=CC(=C1)N=NC2=CC=NC=C2)OCCCCCC(=O)O
IUPAC Name	6-[2-propyl-4-(pyridin-4-yldiazenyl)phenoxy]hexanoic acid
InChI Key	RKSDFQDWVOJLAU-UHFFFAOYSA-N
Molecular Formula	C20H25N3O3

235

3,4-Dimethoxyphenylacetone 97.0+%, TCI America™

CAS: 776-99-8 Molecular Formula: C11H14O3 Molecular Weight (g/mol): 194.23 MDL Number: MFCD00008772 InChI Key: UMYZWICEDUEWIM-UHFFFAOYSA-N Synonym: 3,4-dimethoxyphenylacetone,1-3,4-dimethoxyphenyl propan-2-one,3,4-dimethoxyphenyl acetone,veratryl-2-propanone,1-3,4-dimethoxyphenyl-2-propanone,veratryl acetone,3,4-dimethoxybenzyl methyl ketone,1-3,4-dimethoxyphenyl acetone,2-propanone, 1-3,4-dimethoxyphenyl,veratryl methyl ketone PubChem CID: 69896 IUPAC Name: 1-(3,4-dimethoxyphenyl)propan-2-one SMILES: COC1=CC=C(CC(C)=O)C=C1OC

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PubChem CID	69896
CAS	776-99-8
Molecular Weight (g/mol)	194.23
MDL Number	MFCD00008772
SMILES	COC1=CC=C(CC(C)=O)C=C1OC
Synonym	3,4-dimethoxyphenylacetone,1-3,4-dimethoxyphenyl propan-2-one,3,4-dimethoxyphenyl acetone,veratryl-2-propanone,1-3,4-dimethoxyphenyl-2-propanone,veratryl acetone,3,4-dimethoxybenzyl methyl ketone,1-3,4-dimethoxyphenyl acetone,2-propanone, 1-3,4-dimethoxyphenyl,veratryl methyl ketone
IUPAC Name	1-(3,4-dimethoxyphenyl)propan-2-one
InChI Key	UMYZWICEDUEWIM-UHFFFAOYSA-N
Molecular Formula	C11H14O3

236

4-(4-Propylphenyl)benzoic Acid 98.0+%, TCI America™

CAS: 88038-94-2 Molecular Formula: C16H16O2 Molecular Weight (g/mol): 240.302 MDL Number: MFCD00017335 InChI Key: HCPBURTZSXRGBN-UHFFFAOYSA-N Synonym: 4-4-propylphenyl benzoic acid,4-4-n-propylphenyl benzoic acid,4'-propyl-1,1'-biphenyl-4-carboxylic acid,4-propylbiphenyl-4'-carboxylic acid,4-propyl-4'-biphenylcarboxylic acid,4'-propylbiphenyl-4-carboxylic acid,4-n-propylbiphenyl-4'-carboxylic acid,4-p-n-propylphenyl benzoic acid,1,1'-biphenyl-4-carboxylic acid, 4'-propyl,4'-n-propylbiphenyl-4-carboxylic acid PubChem CID: 522891 IUPAC Name: 4-(4-propylphenyl)benzoic acid SMILES: CCCC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)O

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PubChem CID	522891
CAS	88038-94-2
Molecular Weight (g/mol)	240.302
MDL Number	MFCD00017335
SMILES	CCCC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)O
Synonym	4-4-propylphenyl benzoic acid,4-4-n-propylphenyl benzoic acid,4'-propyl-1,1'-biphenyl-4-carboxylic acid,4-propylbiphenyl-4'-carboxylic acid,4-propyl-4'-biphenylcarboxylic acid,4'-propylbiphenyl-4-carboxylic acid,4-n-propylbiphenyl-4'-carboxylic acid,4-p-n-propylphenyl benzoic acid,1,1'-biphenyl-4-carboxylic acid, 4'-propyl,4'-n-propylbiphenyl-4-carboxylic acid
IUPAC Name	4-(4-propylphenyl)benzoic acid
InChI Key	HCPBURTZSXRGBN-UHFFFAOYSA-N
Molecular Formula	C16H16O2

237

1-tert-Butyl-4-chlorobenzene 98.0+%, TCI America™

CAS: 3972-56-3 Molecular Formula: C10H13Cl Molecular Weight (g/mol): 168.664 InChI Key: XRTANKYQJQXSFP-UHFFFAOYSA-N PubChem CID: 77594 IUPAC Name: 1-tert-butyl-4-chlorobenzene SMILES: CC(C)(C)C1=CC=C(C=C1)Cl

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PubChem CID	77594
CAS	3972-56-3
Molecular Weight (g/mol)	168.664
SMILES	CC(C)(C)C1=CC=C(C=C1)Cl
IUPAC Name	1-tert-butyl-4-chlorobenzene
InChI Key	XRTANKYQJQXSFP-UHFFFAOYSA-N
Molecular Formula	C10H13Cl

238

3-(4-tert-Butylphenyl)isobutyraldehyde 96.0+%, TCI America™

CAS: 80-54-6 Molecular Formula: C14H20O Molecular Weight (g/mol): 204.31 MDL Number: MFCD00047655 InChI Key: SDQFDHOLCGWZPU-UHFFFAOYNA-N Synonym: lilial,3-4-tert-butyl phenyl-2-methylpropanal,3-4-tert-butylphenyl isobutyraldehyde,lilyal,lily aldehyde,3-4-tert-butylphenyl-2-methylpropanal,3-4-tert-butylphenyl-2-methylpropionaldehyde,benzenepropanal, 4-1,1-dimethylethyl-.alpha.-methyl,butylphenyl methylpropional,2-4-tert-butylbenzyl propionaldehyde PubChem CID: 228987 IUPAC Name: 3-(4-tert-butylphenyl)-2-methylpropanal SMILES: CC(CC1=CC=C(C=C1)C(C)(C)C)C=O

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PubChem CID	228987
CAS	80-54-6
Molecular Weight (g/mol)	204.31
MDL Number	MFCD00047655
SMILES	CC(CC1=CC=C(C=C1)C(C)(C)C)C=O
Synonym	lilial,3-4-tert-butyl phenyl-2-methylpropanal,3-4-tert-butylphenyl isobutyraldehyde,lilyal,lily aldehyde,3-4-tert-butylphenyl-2-methylpropanal,3-4-tert-butylphenyl-2-methylpropionaldehyde,benzenepropanal, 4-1,1-dimethylethyl-.alpha.-methyl,butylphenyl methylpropional,2-4-tert-butylbenzyl propionaldehyde
IUPAC Name	3-(4-tert-butylphenyl)-2-methylpropanal
InChI Key	SDQFDHOLCGWZPU-UHFFFAOYNA-N
Molecular Formula	C14H20O

239

1-tert-Butyl-4-iodobenzene 95.0+%, TCI America™

CAS: 35779-04-5 Molecular Formula: C10H13I Molecular Weight (g/mol): 260.118 MDL Number: MFCD00052339 InChI Key: WQVIVQDHNKQWTM-UHFFFAOYSA-N Synonym: 1-tert-butyl-4-iodobenzene,4-tert-butyliodobenzene,4-t-butyliodobenzene,1-iodo-4-tert-butylbenzene,benzene, 1-1,1-dimethylethyl-4-iodo,4-tert-butyl-1-iodobenzene,2-4-iodophenyl-2-methylpropane,2-4'-iodophenyl-2-methylpropane,pubchem3974,4-t-butyl-iodobenzene PubChem CID: 142029 IUPAC Name: 1-tert-butyl-4-iodobenzene SMILES: CC(C)(C)C1=CC=C(C=C1)I

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Specifications

PubChem CID	142029
CAS	35779-04-5
Molecular Weight (g/mol)	260.118
MDL Number	MFCD00052339
SMILES	CC(C)(C)C1=CC=C(C=C1)I
Synonym	1-tert-butyl-4-iodobenzene,4-tert-butyliodobenzene,4-t-butyliodobenzene,1-iodo-4-tert-butylbenzene,benzene, 1-1,1-dimethylethyl-4-iodo,4-tert-butyl-1-iodobenzene,2-4-iodophenyl-2-methylpropane,2-4'-iodophenyl-2-methylpropane,pubchem3974,4-t-butyl-iodobenzene
IUPAC Name	1-tert-butyl-4-iodobenzene
InChI Key	WQVIVQDHNKQWTM-UHFFFAOYSA-N
Molecular Formula	C10H13I

240

4-Bromo-2,6-di-tert-butylphenol 98.0+%, TCI America™

CAS: 1139-52-2 Molecular Formula: C14H21BrO Molecular Weight (g/mol): 285.225 MDL Number: MFCD00051598 InChI Key: SSQQUEKFNSJLKX-UHFFFAOYSA-N Synonym: 4-bromo-2,6-di-tert-butylphenol,2,6-di-tert-butyl-4-bromophenol,4-bromo-2,6-di-t-butylphenol,phenol, 4-bromo-2,6-bis 1,1-dimethylethyl,2,6-bis tert-butyl-4-bromophenol,4-bromo-2,6-di tert-butyl phenol,4-bromo-2,6-di-tert-butyl phenol,4-bromo-2,6-bis 1,1-dimethylethyl phenol,phenol, 4-bromo-2,6-di-tert-butyl,acmc-1c5t6 PubChem CID: 70829 IUPAC Name: 4-bromo-2,6-ditert-butylphenol SMILES: CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)Br

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Specifications

PubChem CID	70829
CAS	1139-52-2
Molecular Weight (g/mol)	285.225
MDL Number	MFCD00051598
SMILES	CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)Br
Synonym	4-bromo-2,6-di-tert-butylphenol,2,6-di-tert-butyl-4-bromophenol,4-bromo-2,6-di-t-butylphenol,phenol, 4-bromo-2,6-bis 1,1-dimethylethyl,2,6-bis tert-butyl-4-bromophenol,4-bromo-2,6-di tert-butyl phenol,4-bromo-2,6-di-tert-butyl phenol,4-bromo-2,6-bis 1,1-dimethylethyl phenol,phenol, 4-bromo-2,6-di-tert-butyl,acmc-1c5t6
IUPAC Name	4-bromo-2,6-ditert-butylphenol
InChI Key	SSQQUEKFNSJLKX-UHFFFAOYSA-N
Molecular Formula	C14H21BrO

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