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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286 – 300 of 1,176 results

286

4-tert-Butylaniline 98.0+%, TCI America™

CAS: 769-92-6 Molecular Formula: C10H15N Molecular Weight (g/mol): 149.237 MDL Number: MFCD00007899 InChI Key: WRDWWAVNELMWAM-UHFFFAOYSA-N Synonym: 4-tert-butyl aniline,p-tert-butylaniline,benzenamine, 4-1,1-dimethylethyl,p-t-butylaniline,4-t-butylaniline,unii-47h9440zow,4-t-butylbenzeneamine,4-tert-butylbenzenamine,4-tert-butylbenzeneamine PubChem CID: 69861 IUPAC Name: 4-tert-butylaniline SMILES: CC(C)(C)C1=CC=C(C=C1)N

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Specifications

PubChem CID	69861
CAS	769-92-6
Molecular Weight (g/mol)	149.237
MDL Number	MFCD00007899
SMILES	CC(C)(C)C1=CC=C(C=C1)N
Synonym	4-tert-butyl aniline,p-tert-butylaniline,benzenamine, 4-1,1-dimethylethyl,p-t-butylaniline,4-t-butylaniline,unii-47h9440zow,4-t-butylbenzeneamine,4-tert-butylbenzenamine,4-tert-butylbenzeneamine
IUPAC Name	4-tert-butylaniline
InChI Key	WRDWWAVNELMWAM-UHFFFAOYSA-N
Molecular Formula	C10H15N

287

4-[Difluoro(3,4,5-trifluorophenoxy)methyl]-3,5-difluoro-4'-propylbiphenyl 98.0+%, TCI America™

CAS: 303186-20-1 Molecular Formula: C22H15F7O Molecular Weight (g/mol): 428.35 MDL Number: MFCD18451990 InChI Key: YJUHXJQZJUQYJJ-UHFFFAOYSA-N Synonym: 4-difluoro 3,4,5-trifluorophenoxy methyl-3,5-difluoro-4'-propyl-1,1'-biphenyl,4-difluoro 3,4,5-trifluorophenoxy methyl-3,5-difluoro-4'-propylbiphenyl,4-3,4,5-trifluorophenoxydifluoromethyl-3,5-difluoro-4'-propylbiphenyl,2-difluoro-3,4,5-trifluorophenoxy methyl-1,3-difluoro-5-4-pro pylphenyl benzene,4-difluoro 3,4,5-trifluorophenoxy methyl-3,5-difluoro-4-propyl-1,1-biphenyl,4-difluoro 3,4,5-trifluorophenoxy methyl-3,5-difluoro-4'-n-propylbiphenyl PubChem CID: 20654145 IUPAC Name: 2-[difluoro-(3,4,5-trifluorophenoxy)methyl]-1,3-difluoro-5-(4-propylphenyl)benzene SMILES: CCCC1=CC=C(C=C1)C2=CC(=C(C(=C2)F)C(OC3=CC(=C(C(=C3)F)F)F)(F)F)F

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PubChem CID	20654145
CAS	303186-20-1
Molecular Weight (g/mol)	428.35
MDL Number	MFCD18451990
SMILES	CCCC1=CC=C(C=C1)C2=CC(=C(C(=C2)F)C(OC3=CC(=C(C(=C3)F)F)F)(F)F)F
Synonym	4-difluoro 3,4,5-trifluorophenoxy methyl-3,5-difluoro-4'-propyl-1,1'-biphenyl,4-difluoro 3,4,5-trifluorophenoxy methyl-3,5-difluoro-4'-propylbiphenyl,4-3,4,5-trifluorophenoxydifluoromethyl-3,5-difluoro-4'-propylbiphenyl,2-difluoro-3,4,5-trifluorophenoxy methyl-1,3-difluoro-5-4-pro pylphenyl benzene,4-difluoro 3,4,5-trifluorophenoxy methyl-3,5-difluoro-4-propyl-1,1-biphenyl,4-difluoro 3,4,5-trifluorophenoxy methyl-3,5-difluoro-4'-n-propylbiphenyl
IUPAC Name	2-[difluoro-(3,4,5-trifluorophenoxy)methyl]-1,3-difluoro-5-(4-propylphenyl)benzene
InChI Key	YJUHXJQZJUQYJJ-UHFFFAOYSA-N
Molecular Formula	C22H15F7O

288

(R)-(+)-1-Phenyl-1-propanol 98.0+%, TCI America™

CAS: 1565-74-8 Molecular Formula: C9H12O Molecular Weight (g/mol): 136.194 MDL Number: MFCD00064279 InChI Key: DYUQAZSOFZSPHD-SECBINFHSA-N Synonym: r-+-1-phenyl-1-propanol,r-1-phenylpropan-1-ol,1r-1-phenylpropan-1-ol,r-1-phenyl-1-propanol,r-1-phenyl-propanol,r-+-alpha-ethylbenzyl alcohol,r-+-1-phenylpropanol,r-1-phenylpropanol,1-phenyl-1-propanol #,r-1-phenyl-1propanol PubChem CID: 640199 IUPAC Name: (1R)-1-phenylpropan-1-ol SMILES: CCC(C1=CC=CC=C1)O

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PubChem CID	640199
CAS	1565-74-8
Molecular Weight (g/mol)	136.194
MDL Number	MFCD00064279
SMILES	CCC(C1=CC=CC=C1)O
Synonym	r-+-1-phenyl-1-propanol,r-1-phenylpropan-1-ol,1r-1-phenylpropan-1-ol,r-1-phenyl-1-propanol,r-1-phenyl-propanol,r-+-alpha-ethylbenzyl alcohol,r-+-1-phenylpropanol,r-1-phenylpropanol,1-phenyl-1-propanol #,r-1-phenyl-1propanol
IUPAC Name	(1R)-1-phenylpropan-1-ol
InChI Key	DYUQAZSOFZSPHD-SECBINFHSA-N
Molecular Formula	C9H12O

289

4-Fluorophenylacetone 98.0+%, TCI America™

CAS: 459-03-0 Molecular Formula: C9H9FO Molecular Weight (g/mol): 152.17 MDL Number: MFCD00000362 InChI Key: ZUEKIIWSVFBTCM-UHFFFAOYSA-N Synonym: 4-fluorophenylacetone,4-fluorophenyl acetone,1-4-fluorophenyl propan-2-one,1-4-fluorophenyl acetone,1-4-fluorophenyl-2-propanone,2-propanone, 1-4-fluorophenyl,p-fluorophenyl acetone,1-acetonyl-4-fluorobenzene,1-4-fluoro-phenyl-propan-2-one PubChem CID: 521187 IUPAC Name: 1-(4-fluorophenyl)propan-2-one SMILES: CC(=O)CC1=CC=C(F)C=C1

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Specifications

PubChem CID	521187
CAS	459-03-0
Molecular Weight (g/mol)	152.17
MDL Number	MFCD00000362
SMILES	CC(=O)CC1=CC=C(F)C=C1
Synonym	4-fluorophenylacetone,4-fluorophenyl acetone,1-4-fluorophenyl propan-2-one,1-4-fluorophenyl acetone,1-4-fluorophenyl-2-propanone,2-propanone, 1-4-fluorophenyl,p-fluorophenyl acetone,1-acetonyl-4-fluorobenzene,1-4-fluoro-phenyl-propan-2-one
IUPAC Name	1-(4-fluorophenyl)propan-2-one
InChI Key	ZUEKIIWSVFBTCM-UHFFFAOYSA-N
Molecular Formula	C9H9FO

290

Methyl 3,5-Di-tert-butylbenzoate 98.0+%, TCI America™

CAS: 64277-87-8 Molecular Formula: C16H24O2 Molecular Weight (g/mol): 248.37 MDL Number: MFCD03844786 InChI Key: ZEIOQJMJXFVPOG-UHFFFAOYSA-N Synonym: 3,5-Di-tert-butylbenzoic Acid Methyl Ester PubChem CID: 13267559 IUPAC Name: methyl 3,5-di-tert-butylbenzoate SMILES: COC(=O)C1=CC(=CC(=C1)C(C)(C)C)C(C)(C)C

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Specifications

PubChem CID	13267559
CAS	64277-87-8
Molecular Weight (g/mol)	248.37
MDL Number	MFCD03844786
SMILES	COC(=O)C1=CC(=CC(=C1)C(C)(C)C)C(C)(C)C
Synonym	3,5-Di-tert-butylbenzoic Acid Methyl Ester
IUPAC Name	methyl 3,5-di-tert-butylbenzoate
InChI Key	ZEIOQJMJXFVPOG-UHFFFAOYSA-N
Molecular Formula	C16H24O2

291

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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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

292

1,3-Bis[5-(4-tert-butylphenyl)-2-[1,3,4]oxadiazolyl]benzene 97.0+%, TCI America™

CAS: 138372-67-5 Molecular Formula: C30H30N4O2 Molecular Weight (g/mol): 478.60 MDL Number: MFCD03093214 InChI Key: FQJQNLKWTRGIEB-UHFFFAOYSA-N Synonym: 1,3-Bis[5-(4-tert-butylphenyl)-1,3,4-oxadiazol-2-yl]benzene, OXD-7 PubChem CID: 15320492 IUPAC Name: 2-(4-tert-butylphenyl)-5-{3-[5-(4-tert-butylphenyl)-1,3,4-oxadiazol-2-yl]phenyl}-1,3,4-oxadiazole SMILES: CC(C)(C)C1=CC=C(C=C1)C1=NN=C(O1)C1=CC(=CC=C1)C1=NN=C(O1)C1=CC=C(C=C1)C(C)(C)C

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Specifications

PubChem CID	15320492
CAS	138372-67-5
Molecular Weight (g/mol)	478.60
MDL Number	MFCD03093214
SMILES	CC(C)(C)C1=CC=C(C=C1)C1=NN=C(O1)C1=CC(=CC=C1)C1=NN=C(O1)C1=CC=C(C=C1)C(C)(C)C
Synonym	1,3-Bis[5-(4-tert-butylphenyl)-1,3,4-oxadiazol-2-yl]benzene, OXD-7
IUPAC Name	2-(4-tert-butylphenyl)-5-{3-[5-(4-tert-butylphenyl)-1,3,4-oxadiazol-2-yl]phenyl}-1,3,4-oxadiazole
InChI Key	FQJQNLKWTRGIEB-UHFFFAOYSA-N
Molecular Formula	C30H30N4O2

293

3,5-Di-tert-butylbenzaldehyde 97.0+%, TCI America™

CAS: 17610-00-3 Molecular Formula: C15H22O Molecular Weight (g/mol): 218.34 MDL Number: MFCD00026298 InChI Key: BRUITYMDHWNCIG-UHFFFAOYSA-N Synonym: 3,5-di-tert-butylbenzaldehyde,3,5-bis tert-butyl benzaldehyde,3,5-di-t-butylbenzaldehyde,3,5-bis tert-butyl-1-formylbenzene,benzaldehyde, 3,5-bis 1,1-dimethylethyl,3,5-di-tert-butyl-benzaldehyde,acmc-20ai73,3,5-di-tertbutylbenzaldehyde,ksc181g1d,3,5-di-tert butylbenzaldehyde PubChem CID: 1268253 IUPAC Name: 3,5-di-tert-butylbenzaldehyde SMILES: CC(C)(C)C1=CC(=CC(C=O)=C1)C(C)(C)C

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PubChem CID	1268253
CAS	17610-00-3
Molecular Weight (g/mol)	218.34
MDL Number	MFCD00026298
SMILES	CC(C)(C)C1=CC(=CC(C=O)=C1)C(C)(C)C
Synonym	3,5-di-tert-butylbenzaldehyde,3,5-bis tert-butyl benzaldehyde,3,5-di-t-butylbenzaldehyde,3,5-bis tert-butyl-1-formylbenzene,benzaldehyde, 3,5-bis 1,1-dimethylethyl,3,5-di-tert-butyl-benzaldehyde,acmc-20ai73,3,5-di-tertbutylbenzaldehyde,ksc181g1d,3,5-di-tert butylbenzaldehyde
IUPAC Name	3,5-di-tert-butylbenzaldehyde
InChI Key	BRUITYMDHWNCIG-UHFFFAOYSA-N
Molecular Formula	C15H22O

294

4-tert-Butylbenzylamine 98.0+%, TCI America™

CAS: 39895-55-1 Molecular Formula: C11H17N Molecular Weight (g/mol): 163.264 MDL Number: MFCD00040754 InChI Key: MPWSRGAWRAYBJK-UHFFFAOYSA-N Synonym: 4-tert-butylbenzylamine,4-tert-butylphenyl methanamine,4-t-butylbenzylamine,1-4-tert-butylphenyl methanamine,4-tert-butyl-benzylamine,4-tert-butyl phenyl methanamine,4-tert-butyl phenyl methylamine,4t-butylbenzylamine,p-t-butylbenzylamine,4-tertbutylbenzylamine PubChem CID: 2735655 IUPAC Name: (4-tert-butylphenyl)methanamine SMILES: CC(C)(C)C1=CC=C(C=C1)CN

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PubChem CID	2735655
CAS	39895-55-1
Molecular Weight (g/mol)	163.264
MDL Number	MFCD00040754
SMILES	CC(C)(C)C1=CC=C(C=C1)CN
Synonym	4-tert-butylbenzylamine,4-tert-butylphenyl methanamine,4-t-butylbenzylamine,1-4-tert-butylphenyl methanamine,4-tert-butyl-benzylamine,4-tert-butyl phenyl methanamine,4-tert-butyl phenyl methylamine,4t-butylbenzylamine,p-t-butylbenzylamine,4-tertbutylbenzylamine
IUPAC Name	(4-tert-butylphenyl)methanamine
InChI Key	MPWSRGAWRAYBJK-UHFFFAOYSA-N
Molecular Formula	C11H17N

295

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

296

1-sec-Butyl-2-nitrobenzene 98.0+%, TCI America™

CAS: 19370-34-4 Molecular Formula: C10H13NO2 Molecular Weight (g/mol): 179.219 InChI Key: GMQQDASXGTUDPJ-UHFFFAOYSA-N PubChem CID: 86858 IUPAC Name: 1-butan-2-yl-2-nitrobenzene SMILES: CCC(C)C1=CC=CC=C1[N+](=O)[O-]

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PubChem CID	86858
CAS	19370-34-4
Molecular Weight (g/mol)	179.219
SMILES	CCC(C)C1=CC=CC=C1[N+](=O)[O-]
IUPAC Name	1-butan-2-yl-2-nitrobenzene
InChI Key	GMQQDASXGTUDPJ-UHFFFAOYSA-N
Molecular Formula	C10H13NO2

297

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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Specifications

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

298

4-tert-Butylbenzoic Acid 99.0+%, TCI America™

CAS: 98-73-7 Molecular Formula: C11H14O2 Molecular Weight (g/mol): 178.23 MDL Number: MFCD00002563 InChI Key: KDVYCTOWXSLNNI-UHFFFAOYSA-N Synonym: 4-tert-butyl benzoic acid,tbba,p-tert-butylbenzoic acid,benzoic acid, 4-1,1-dimethylethyl,4-t-butylbenzoic acid,benzoic acid, p-tert-butyl,4-tert-butyl-benzoic acid,p-t-butylbenzoic acid,4-tert-butylbenzoicacid,unii-43z7t3vn0r PubChem CID: 7403 ChEBI: CHEBI:34443 IUPAC Name: 4-tert-butylbenzoic acid SMILES: CC(C)(C)C1=CC=C(C=C1)C(O)=O

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PubChem CID	7403
CAS	98-73-7
Molecular Weight (g/mol)	178.23
ChEBI	CHEBI:34443
MDL Number	MFCD00002563
SMILES	CC(C)(C)C1=CC=C(C=C1)C(O)=O
Synonym	4-tert-butyl benzoic acid,tbba,p-tert-butylbenzoic acid,benzoic acid, 4-1,1-dimethylethyl,4-t-butylbenzoic acid,benzoic acid, p-tert-butyl,4-tert-butyl-benzoic acid,p-t-butylbenzoic acid,4-tert-butylbenzoicacid,unii-43z7t3vn0r
IUPAC Name	4-tert-butylbenzoic acid
InChI Key	KDVYCTOWXSLNNI-UHFFFAOYSA-N
Molecular Formula	C11H14O2

299

4-tert-Butylbenzaldehyde 95.0+%, TCI America™

CAS: 939-97-9 Molecular Formula: C11H14O Molecular Weight (g/mol): 162.23 MDL Number: MFCD00035742 InChI Key: OTXINXDGSUFPNU-UHFFFAOYSA-N Synonym: 4-tert-butyl benzaldehyde,p-t-butylbenzaldehyde,p-tertbutyl benzaldehyde,benzaldehyde, 4-1,1-dimethylethyl,p-tert-butylbenzaldehyde,4-t-butylbenzaldehyde,4-tert-butyl-benzaldehyde,unii-qxf0qy8503,4-t-butyl benzaldehyde,benzaldehyde, p-tert-butyl PubChem CID: 70324 IUPAC Name: 4-tert-butylbenzaldehyde SMILES: CC(C)(C)C1=CC=C(C=O)C=C1

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Specifications

PubChem CID	70324
CAS	939-97-9
Molecular Weight (g/mol)	162.23
MDL Number	MFCD00035742
SMILES	CC(C)(C)C1=CC=C(C=O)C=C1
Synonym	4-tert-butyl benzaldehyde,p-t-butylbenzaldehyde,p-tertbutyl benzaldehyde,benzaldehyde, 4-1,1-dimethylethyl,p-tert-butylbenzaldehyde,4-t-butylbenzaldehyde,4-tert-butyl-benzaldehyde,unii-qxf0qy8503,4-t-butyl benzaldehyde,benzaldehyde, p-tert-butyl
IUPAC Name	4-tert-butylbenzaldehyde
InChI Key	OTXINXDGSUFPNU-UHFFFAOYSA-N
Molecular Formula	C11H14O

300

(1S,2R)-1-Phenyl-2-(1-pyrrolidinyl)propan-1-ol 98.0+%, TCI America™

CAS: 123620-80-4 Molecular Formula: C13H19NO Molecular Weight (g/mol): 205.30 MDL Number: MFCD02093492 InChI Key: FZVHJGJBJLFWEX-UHFFFAOYNA-N Synonym: 1s,2r-1-phenyl-2-pyrrolidin-1-yl propan-1-ol,1s,2r-1-phenyl-2-1-pyrrolidinyl propan-1-ol,1s,2r-1-phenyl-2-pyrrolidin-1-yl-propan-1-ol,1s,2r-1-phenyl-2-1-pyrrolidinyl-1-propanol,1s,2r-n,n-tetramethylenenorephedrine,1-phenyl-2-pyrrolidin-1-yl propan-1-ol, 1s,2r,1-pyrrolidineethanol, beta-methyl-alpha-phenyl-, alphas,betar,pubchem8276,pubchem14465,1s,2r-1-phenyl-2-pyrrolizino-1-propanol PubChem CID: 9942483 IUPAC Name: 1-phenyl-2-(pyrrolidin-1-yl)propan-1-ol SMILES: CC(C(O)C1=CC=CC=C1)N1CCCC1

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Specifications

PubChem CID	9942483
CAS	123620-80-4
Molecular Weight (g/mol)	205.30
MDL Number	MFCD02093492
SMILES	CC(C(O)C1=CC=CC=C1)N1CCCC1
Synonym	1s,2r-1-phenyl-2-pyrrolidin-1-yl propan-1-ol,1s,2r-1-phenyl-2-1-pyrrolidinyl propan-1-ol,1s,2r-1-phenyl-2-pyrrolidin-1-yl-propan-1-ol,1s,2r-1-phenyl-2-1-pyrrolidinyl-1-propanol,1s,2r-n,n-tetramethylenenorephedrine,1-phenyl-2-pyrrolidin-1-yl propan-1-ol, 1s,2r,1-pyrrolidineethanol, beta-methyl-alpha-phenyl-, alphas,betar,pubchem8276,pubchem14465,1s,2r-1-phenyl-2-pyrrolizino-1-propanol
IUPAC Name	1-phenyl-2-(pyrrolidin-1-yl)propan-1-ol
InChI Key	FZVHJGJBJLFWEX-UHFFFAOYNA-N
Molecular Formula	C13H19NO

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