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Diphenylmethanes

Organic compounds that consist of two phenyl rings bonded to the same carbon atom; the diphenylmethyl group is also known as benzhydryl.
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1
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Methylene di-p-phenyl diisocyanate, 98%, flakes

CAS: 101-68-8 Molecular Formula: C15H10N2O2 Molecular Weight (g/mol): 250.26 MDL Number: MFCD00036131 InChI Key: UPMLOUAZCHDJJD-UHFFFAOYSA-N Synonym: 4,4'-diphenylmethane diisocyanate,diphenylmethane diisocyanate,isonate,4,4'-diisocyanatodiphenylmethane,p,p'-diphenylmethane diisocyanate,bis 4-isocyanatophenyl methane,4,4'-methylenebis phenyl isocyanate,methylbisphenyl isocyanate,1,1'-methylenebis 4-isocyanatobenzene,methylene diphenyl diisocyanate PubChem CID: 7570 ChEBI: CHEBI:53218 IUPAC Name: 1-isocyanato-4-[(4-isocyanatophenyl)methyl]benzene SMILES: C1=CC(=CC=C1CC2=CC=C(C=C2)N=C=O)N=C=O

EDGE
PubChem CID 7570
CAS 101-68-8
Molecular Weight (g/mol) 250.26
ChEBI CHEBI:53218
MDL Number MFCD00036131
SMILES C1=CC(=CC=C1CC2=CC=C(C=C2)N=C=O)N=C=O
Synonym 4,4'-diphenylmethane diisocyanate,diphenylmethane diisocyanate,isonate,4,4'-diisocyanatodiphenylmethane,p,p'-diphenylmethane diisocyanate,bis 4-isocyanatophenyl methane,4,4'-methylenebis phenyl isocyanate,methylbisphenyl isocyanate,1,1'-methylenebis 4-isocyanatobenzene,methylene diphenyl diisocyanate
IUPAC Name 1-isocyanato-4-[(4-isocyanatophenyl)methyl]benzene
InChI Key UPMLOUAZCHDJJD-UHFFFAOYSA-N
Molecular Formula C15H10N2O2
2

alpha,alpha'-Bis(4-aminophenyl)-1,4-diisopropylbenzene 99.0+%, TCI America™

CAS: 2716-10-1 Molecular Formula: C24H28N2 Molecular Weight (g/mol): 344.50 MDL Number: MFCD00191313 InChI Key: HESXPOICBNWMPI-UHFFFAOYSA-N PubChem CID: 75930 IUPAC Name: 4-[2-[4-[2-(4-aminophenyl)propan-2-yl]phenyl]propan-2-yl]aniline SMILES: CC(C)(C1=CC=C(C=C1)C(C)(C)C2=CC=C(C=C2)N)C3=CC=C(C=C3)N

PubChem CID 75930
CAS 2716-10-1
Molecular Weight (g/mol) 344.50
MDL Number MFCD00191313
SMILES CC(C)(C1=CC=C(C=C1)C(C)(C)C2=CC=C(C=C2)N)C3=CC=C(C=C3)N
IUPAC Name 4-[2-[4-[2-(4-aminophenyl)propan-2-yl]phenyl]propan-2-yl]aniline
InChI Key HESXPOICBNWMPI-UHFFFAOYSA-N
Molecular Formula C24H28N2
3

2-Ethylhexyl 2-Cyano-3,3-diphenylacrylate 98.0+%, TCI America™

CAS: 6197-30-4 Molecular Formula: C24H27NO2 Molecular Weight (g/mol): 361.49 MDL Number: MFCD00059260 InChI Key: FMJSMJQBSVNSBF-UHFFFAOYNA-N Synonym: 2-Cyano-3,3-diphenylacrylic Acid 2-Ethylhexyl Ester, Octyl 2-Cyano-3,3-diphenylacrylate PubChem CID: 22571 IUPAC Name: 2-ethylhexyl 2-cyano-3,3-diphenylprop-2-enoate SMILES: CCCCC(CC)COC(=O)C(C#N)=C(C1=CC=CC=C1)C1=CC=CC=C1

PubChem CID 22571
CAS 6197-30-4
Molecular Weight (g/mol) 361.49
MDL Number MFCD00059260
SMILES CCCCC(CC)COC(=O)C(C#N)=C(C1=CC=CC=C1)C1=CC=CC=C1
Synonym 2-Cyano-3,3-diphenylacrylic Acid 2-Ethylhexyl Ester, Octyl 2-Cyano-3,3-diphenylacrylate
IUPAC Name 2-ethylhexyl 2-cyano-3,3-diphenylprop-2-enoate
InChI Key FMJSMJQBSVNSBF-UHFFFAOYNA-N
Molecular Formula C24H27NO2
4

Allopurinol Impurity C, British Pharmacopoeia (BP) Reference Standard, MilliporeSigma™ Supelco™

This product is provided as delivered and specified by the issuing Pharmacopoeia. All information provided in support of this product, including SDS and any product information leaflets, has been developed and issued under the Authority of the issuing Pharmacopoeia.

5

1,1-Diphenylacetone 99.0+%, TCI America™

CAS: 781-35-1 Molecular Formula: C15H14O Molecular Weight (g/mol): 210.276 MDL Number: MFCD00008759 InChI Key: DBNWBEGCONIRGQ-UHFFFAOYSA-N Synonym: 1,1-diphenylacetone,1,1-diphenyl-2-propanone,2-propanone, 1,1-diphenyl,1,1-diphenyl acetone,methyl diphenylmethyl ketone,ketone, diphenylmethyl methyl,benzhydryl methyl ketone,diphenylacetone,3,3-diphenyl acetone,2-propanone, diphenyl PubChem CID: 69907 IUPAC Name: 1,1-diphenylpropan-2-one SMILES: CC(=O)C(C1=CC=CC=C1)C2=CC=CC=C2

PubChem CID 69907
CAS 781-35-1
Molecular Weight (g/mol) 210.276
MDL Number MFCD00008759
SMILES CC(=O)C(C1=CC=CC=C1)C2=CC=CC=C2
Synonym 1,1-diphenylacetone,1,1-diphenyl-2-propanone,2-propanone, 1,1-diphenyl,1,1-diphenyl acetone,methyl diphenylmethyl ketone,ketone, diphenylmethyl methyl,benzhydryl methyl ketone,diphenylacetone,3,3-diphenyl acetone,2-propanone, diphenyl
IUPAC Name 1,1-diphenylpropan-2-one
InChI Key DBNWBEGCONIRGQ-UHFFFAOYSA-N
Molecular Formula C15H14O
6

2,2-Bis(4-cyanatophenyl)propane 98.0+%, TCI America™

CAS: 1156-51-0 Molecular Formula: C17H14N2O2 Molecular Weight (g/mol): 278.311 MDL Number: MFCD00037423 InChI Key: AHZMUXQJTGRNHT-UHFFFAOYSA-N Synonym: Bisphenol A Dicyanate, 4,4′C-Isopropylidenebis(cyanatobenzene) PubChem CID: 70872 IUPAC Name: [4-[2-(4-cyanatophenyl)propan-2-yl]phenyl] cyanate SMILES: CC(C)(C1=CC=C(C=C1)OC#N)C2=CC=C(C=C2)OC#N

PubChem CID 70872
CAS 1156-51-0
Molecular Weight (g/mol) 278.311
MDL Number MFCD00037423
SMILES CC(C)(C1=CC=C(C=C1)OC#N)C2=CC=C(C=C2)OC#N
Synonym Bisphenol A Dicyanate, 4,4′C-Isopropylidenebis(cyanatobenzene)
IUPAC Name [4-[2-(4-cyanatophenyl)propan-2-yl]phenyl] cyanate
InChI Key AHZMUXQJTGRNHT-UHFFFAOYSA-N
Molecular Formula C17H14N2O2
7

Cetirizine dihydrochloride, 99+%

CAS: 83881-52-1 Molecular Formula: C21H27Cl3N2O3 Molecular Weight (g/mol): 461.81 MDL Number: MFCD00941428 InChI Key: PGLIUCLTXOYQMV-UHFFFAOYNA-N Synonym: cetirizine dihydrochloride,zyrtec,reactine,cetirizine hydrochloride,2-2-4-4-chlorophenyl phenyl methyl piperazin-1-yl ethoxy acetic acid dihydrochloride,alerlisin,alercet,alergex,alertisin,cetriler PubChem CID: 55182 IUPAC Name: dihydrogen 2-(2-{4-[(4-chlorophenyl)(phenyl)methyl]piperazin-1-yl}ethoxy)acetic acid dichloride SMILES: [H+].[H+].[Cl-].[Cl-].OC(=O)COCCN1CCN(CC1)C(C1=CC=CC=C1)C1=CC=C(Cl)C=C1

PubChem CID 55182
CAS 83881-52-1
Molecular Weight (g/mol) 461.81
MDL Number MFCD00941428
SMILES [H+].[H+].[Cl-].[Cl-].OC(=O)COCCN1CCN(CC1)C(C1=CC=CC=C1)C1=CC=C(Cl)C=C1
Synonym cetirizine dihydrochloride,zyrtec,reactine,cetirizine hydrochloride,2-2-4-4-chlorophenyl phenyl methyl piperazin-1-yl ethoxy acetic acid dihydrochloride,alerlisin,alercet,alergex,alertisin,cetriler
IUPAC Name dihydrogen 2-(2-{4-[(4-chlorophenyl)(phenyl)methyl]piperazin-1-yl}ethoxy)acetic acid dichloride
InChI Key PGLIUCLTXOYQMV-UHFFFAOYNA-N
Molecular Formula C21H27Cl3N2O3
8

GBR 12909 dihydrochloride, Thermo Scientific Chemicals

CAS: 67469-78-7 Molecular Formula: C28H34Cl2F2N2O Molecular Weight (g/mol): 523.49 MDL Number: MFCD00055193 InChI Key: MIBSKSYCRFWIRU-UHFFFAOYSA-N PubChem CID: 104920 ChEBI: CHEBI:64086 IUPAC Name: 1-[2-[bis(4-fluorophenyl)methoxy]ethyl]-4-(3-phenylpropyl)piperazine;dihydrochloride SMILES: C1CN(CCN1CCCC2=CC=CC=C2)CCOC(C3=CC=C(C=C3)F)C4=CC=C(C=C4)F.Cl.Cl

PubChem CID 104920
CAS 67469-78-7
Molecular Weight (g/mol) 523.49
ChEBI CHEBI:64086
MDL Number MFCD00055193
SMILES C1CN(CCN1CCCC2=CC=CC=C2)CCOC(C3=CC=C(C=C3)F)C4=CC=C(C=C4)F.Cl.Cl
IUPAC Name 1-[2-[bis(4-fluorophenyl)methoxy]ethyl]-4-(3-phenylpropyl)piperazine;dihydrochloride
InChI Key MIBSKSYCRFWIRU-UHFFFAOYSA-N
Molecular Formula C28H34Cl2F2N2O
9
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Benzopinacole, 98%, Thermo Scientific Chemicals

CAS: 464-72-2 Molecular Formula: C26H22O2 Molecular Weight (g/mol): 366.45 MDL Number: MFCD00004448 InChI Key: MFEWNFVBWPABCX-UHFFFAOYSA-N Synonym: benzopinacol,benzopinacole,benzopinacone,benzpinacol,benzpinacone,tetraphenylethylene glycol,tetraphenyl-1,2-ethanediol,benzophenone pinacol,1,1,2,2-tetraphenyl-1,2-ethanediol,1,2-ethanediol, 1,1,2,2-tetraphenyl PubChem CID: 94766 IUPAC Name: 1,1,2,2-tetraphenylethane-1,2-diol SMILES: C1=CC=C(C=C1)C(C2=CC=CC=C2)(C(C3=CC=CC=C3)(C4=CC=CC=C4)O)O

PubChem CID 94766
CAS 464-72-2
Molecular Weight (g/mol) 366.45
MDL Number MFCD00004448
SMILES C1=CC=C(C=C1)C(C2=CC=CC=C2)(C(C3=CC=CC=C3)(C4=CC=CC=C4)O)O
Synonym benzopinacol,benzopinacole,benzopinacone,benzpinacol,benzpinacone,tetraphenylethylene glycol,tetraphenyl-1,2-ethanediol,benzophenone pinacol,1,1,2,2-tetraphenyl-1,2-ethanediol,1,2-ethanediol, 1,1,2,2-tetraphenyl
IUPAC Name 1,1,2,2-tetraphenylethane-1,2-diol
InChI Key MFEWNFVBWPABCX-UHFFFAOYSA-N
Molecular Formula C26H22O2
10

Bisacodyl, 98+%

CAS: 603-50-9 Molecular Formula: C22H19NO4 Molecular Weight (g/mol): 361.40 MDL Number: MFCD00038039 InChI Key: KHOITXIGCFIULA-UHFFFAOYSA-N Synonym: bisacodyl,dulcolax,bicol,brocalax,durolax,dulcolan,endokolat,fenilaxan,hillcolax,sanvacual PubChem CID: 2391 IUPAC Name: 4-{[4-(acetyloxy)phenyl](pyridin-2-yl)methyl}phenyl acetate SMILES: CC(=O)OC1=CC=C(C=C1)C(C1=CC=C(OC(C)=O)C=C1)C1=CC=CC=N1

PubChem CID 2391
CAS 603-50-9
Molecular Weight (g/mol) 361.40
MDL Number MFCD00038039
SMILES CC(=O)OC1=CC=C(C=C1)C(C1=CC=C(OC(C)=O)C=C1)C1=CC=CC=N1
Synonym bisacodyl,dulcolax,bicol,brocalax,durolax,dulcolan,endokolat,fenilaxan,hillcolax,sanvacual
IUPAC Name 4-{[4-(acetyloxy)phenyl](pyridin-2-yl)methyl}phenyl acetate
InChI Key KHOITXIGCFIULA-UHFFFAOYSA-N
Molecular Formula C22H19NO4
11
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1,1-Diphenylethylene, 98%

CAS: 530-48-3 Molecular Formula: C14H12 Molecular Weight (g/mol): 180.25 InChI Key: ZMYIIHDQURVDRB-UHFFFAOYSA-N Synonym: 1,1-diphenylethylene,ethene-1,1-diyldibenzene,1,1-diphenylethene,benzene, 1,1'-ethenylidenebis,1-phenylethenyl benzene,unii-bx0l5b6lll,as-diphenylethylene,.alpha.-phenylstyrene,1-phenylvinyl benzene,bx0l5b6lll PubChem CID: 10740 IUPAC Name: 1-phenylethenylbenzene SMILES: C=C(C1=CC=CC=C1)C2=CC=CC=C2

PubChem CID 10740
CAS 530-48-3
Molecular Weight (g/mol) 180.25
SMILES C=C(C1=CC=CC=C1)C2=CC=CC=C2
Synonym 1,1-diphenylethylene,ethene-1,1-diyldibenzene,1,1-diphenylethene,benzene, 1,1'-ethenylidenebis,1-phenylethenyl benzene,unii-bx0l5b6lll,as-diphenylethylene,.alpha.-phenylstyrene,1-phenylvinyl benzene,bx0l5b6lll
IUPAC Name 1-phenylethenylbenzene
InChI Key ZMYIIHDQURVDRB-UHFFFAOYSA-N
Molecular Formula C14H12
12

Cinnarizine 98.0+%, TCI America™

CAS: 298-57-7 Molecular Formula: C26H28N2 Molecular Weight (g/mol): 368.524 MDL Number: MFCD00056037 InChI Key: DERZBLKQOCDDDZ-JLHYYAGUSA-N Synonym: cinnarizine,stugeron,dimitronal,stutgin,dimitron,folcodal,midronal,mitronal,stutgeron,glanil PubChem CID: 1547484 ChEBI: CHEBI:31403 IUPAC Name: 1-benzhydryl-4-[(E)-3-phenylprop-2-enyl]piperazine SMILES: C1CN(CCN1CC=CC2=CC=CC=C2)C(C3=CC=CC=C3)C4=CC=CC=C4

PubChem CID 1547484
CAS 298-57-7
Molecular Weight (g/mol) 368.524
ChEBI CHEBI:31403
MDL Number MFCD00056037
SMILES C1CN(CCN1CC=CC2=CC=CC=C2)C(C3=CC=CC=C3)C4=CC=CC=C4
Synonym cinnarizine,stugeron,dimitronal,stutgin,dimitron,folcodal,midronal,mitronal,stutgeron,glanil
IUPAC Name 1-benzhydryl-4-[(E)-3-phenylprop-2-enyl]piperazine
InChI Key DERZBLKQOCDDDZ-JLHYYAGUSA-N
Molecular Formula C26H28N2
13

(S)-4-Isopropyl-3-(1-naphthylmethyl)-2,5,5-triphenyl-1,3,2-oxazaborolidine, TCI America™

CAS: 850661-66-4 Molecular Formula: C34H32BNO Molecular Weight (g/mol): 481.446 InChI Key: KMDAQDQUTLTEPL-XIFFEERXSA-N PubChem CID: 12195798 IUPAC Name: (4S)-3-(naphthalen-1-ylmethyl)-2,5,5-triphenyl-4-propan-2-yl-1,3,2-oxazaborolidine SMILES: B1(N(C(C(O1)(C2=CC=CC=C2)C3=CC=CC=C3)C(C)C)CC4=CC=CC5=CC=CC=C54)C6=CC=CC=C6

PubChem CID 12195798
CAS 850661-66-4
Molecular Weight (g/mol) 481.446
SMILES B1(N(C(C(O1)(C2=CC=CC=C2)C3=CC=CC=C3)C(C)C)CC4=CC=CC5=CC=CC=C54)C6=CC=CC=C6
IUPAC Name (4S)-3-(naphthalen-1-ylmethyl)-2,5,5-triphenyl-4-propan-2-yl-1,3,2-oxazaborolidine
InChI Key KMDAQDQUTLTEPL-XIFFEERXSA-N
Molecular Formula C34H32BNO
14
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4-Cumylphenol, 97%

CAS: 599-64-4 Molecular Formula: C15H16O Molecular Weight (g/mol): 212.292 MDL Number: MFCD00002365 InChI Key: QBDSZLJBMIMQRS-UHFFFAOYSA-N Synonym: 4-cumylphenol,p-cumylphenol,4-2-phenylpropan-2-yl phenol,p-cumyl phenol,phenol, 4-1-methyl-1-phenylethyl,4-1-methyl-1-phenylethyl phenol,4-alpha-cumylphenol,4-dimethylphenylmethyl phenol,4-hydroxydiphenyldimethylmethane,2-phenyl-2-4-hydroxyphenyl propane PubChem CID: 11742 ChEBI: CHEBI:35092 IUPAC Name: 4-(2-phenylpropan-2-yl)phenol SMILES: CC(C)(C1=CC=CC=C1)C2=CC=C(C=C2)O

PubChem CID 11742
CAS 599-64-4
Molecular Weight (g/mol) 212.292
ChEBI CHEBI:35092
MDL Number MFCD00002365
SMILES CC(C)(C1=CC=CC=C1)C2=CC=C(C=C2)O
Synonym 4-cumylphenol,p-cumylphenol,4-2-phenylpropan-2-yl phenol,p-cumyl phenol,phenol, 4-1-methyl-1-phenylethyl,4-1-methyl-1-phenylethyl phenol,4-alpha-cumylphenol,4-dimethylphenylmethyl phenol,4-hydroxydiphenyldimethylmethane,2-phenyl-2-4-hydroxyphenyl propane
IUPAC Name 4-(2-phenylpropan-2-yl)phenol
InChI Key QBDSZLJBMIMQRS-UHFFFAOYSA-N
Molecular Formula C15H16O
15
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2,2-Diphenylethanol, 97%

CAS: 1883-32-5 Molecular Formula: C14H14O Molecular Weight (g/mol): 198.26 MDL Number: MFCD00004729 InChI Key: NYLOEXLAXYHOHH-UHFFFAOYSA-N Synonym: beta-phenylphenethyl alcohol,2,2-diphenyl ethanol,benzeneethanol, .beta.-phenyl,acmc-20aojg,2,2-diphenyl-ethanol,2,2-diphenyl-1-ethanol,2,2-diphenylethan-1-ol,benzeneethanol, b-phenyl,2,2-diphenylethanol,ksc539o6l PubChem CID: 74662 IUPAC Name: 2,2-diphenylethanol SMILES: C1=CC=C(C=C1)C(CO)C2=CC=CC=C2

PubChem CID 74662
CAS 1883-32-5
Molecular Weight (g/mol) 198.26
MDL Number MFCD00004729
SMILES C1=CC=C(C=C1)C(CO)C2=CC=CC=C2
Synonym beta-phenylphenethyl alcohol,2,2-diphenyl ethanol,benzeneethanol, .beta.-phenyl,acmc-20aojg,2,2-diphenyl-ethanol,2,2-diphenyl-1-ethanol,2,2-diphenylethan-1-ol,benzeneethanol, b-phenyl,2,2-diphenylethanol,ksc539o6l
IUPAC Name 2,2-diphenylethanol
InChI Key NYLOEXLAXYHOHH-UHFFFAOYSA-N
Molecular Formula C14H14O