Benzene and substituted derivatives

Benzene is an aromatic organic molecule composed of six carbon atoms and six hydrogen atoms that form a ring. Includes substituted derivative compounds.

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1,561 – 1,575 of 119,769 results

1,561

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Propylene Phenoxytol, Reagent, Spectrum™ Chemical

CAS: 770-35-4 Molecular Formula: C9H12O2 Molecular Weight (g/mol): 152.19 MDL Number: MFCD00016861 InChI Key: IBLKWZIFZMJLFL-UHFFFAOYNA-N IUPAC Name: 1-phenoxypropan-2-ol SMILES: CC(O)COC1=CC=CC=C1

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CAS	770-35-4
Molecular Weight (g/mol)	152.19
MDL Number	MFCD00016861
SMILES	CC(O)COC1=CC=CC=C1
IUPAC Name	1-phenoxypropan-2-ol
InChI Key	IBLKWZIFZMJLFL-UHFFFAOYNA-N
Molecular Formula	C9H12O2

1,562

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Methylparaben, Spectrum™ Chemical

CAS: 99-76-3

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Specifications

CAS	99-76-3

1,563

LiChropur™ Benzylamine, For GC Derivatization, 99.0%, MilliporeSigma™ Supelco™

CAS: 100-46-9 Molecular Formula: C7H9N Molecular Weight (g/mol): 107.16 MDL Number: MFCD00008106 InChI Key: WGQKYBSKWIADBV-UHFFFAOYSA-N Synonym: alpha-Aminotoluene IUPAC Name: 1-phenylmethanamine SMILES: NCC1=CC=CC=C1

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Specifications

CAS	100-46-9
Molecular Weight (g/mol)	107.16
MDL Number	MFCD00008106
SMILES	NCC1=CC=CC=C1
Synonym	alpha-Aminotoluene
IUPAC Name	1-phenylmethanamine
InChI Key	WGQKYBSKWIADBV-UHFFFAOYSA-N
Molecular Formula	C7H9N

1,564

Pararosanilin Hydrochloride, BAKER™, J.T. Baker™

CAS: 569-61-9 Molecular Formula: C19H18ClN3 Molecular Weight (g/mol): 323.824 InChI Key: JUQPZRLQQYSMEQ-UHFFFAOYSA-N Synonym: basic red 9,pararosaniline hydrochloride,parafuchsin,pararosaniline chloride,parafuchsine,p-fuchsin,basic fuchsin,ci basic red 9,c.i. basic red 9,parafuksin PubChem CID: 11292 ChEBI: CHEBI:87663 IUPAC Name: 4-[(4-aminophenyl)-(4-iminocyclohexa-2,5-dien-1-ylidene)methyl]aniline;hydrochloride SMILES: C1=CC(=N)C=CC1=C(C2=CC=C(C=C2)N)C3=CC=C(C=C3)N.Cl

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Specifications

PubChem CID	11292
CAS	569-61-9
Molecular Weight (g/mol)	323.824
ChEBI	CHEBI:87663
SMILES	C1=CC(=N)C=CC1=C(C2=CC=C(C=C2)N)C3=CC=C(C=C3)N.Cl
Synonym	basic red 9,pararosaniline hydrochloride,parafuchsin,pararosaniline chloride,parafuchsine,p-fuchsin,basic fuchsin,ci basic red 9,c.i. basic red 9,parafuksin
IUPAC Name	4-[(4-aminophenyl)-(4-iminocyclohexa-2,5-dien-1-ylidene)methyl]aniline;hydrochloride
InChI Key	JUQPZRLQQYSMEQ-UHFFFAOYSA-N
Molecular Formula	C19H18ClN3

1,565

LiChropur™ ™-(-)-α-Methoxy-α-(trifluoromethyl)phenylacetyl chloride, 99.0%, MilliporeSigma™ Supelco™

Molecular Formula: C10H8ClF3O2 Molecular Weight (g/mol): 252.62 MDL Number: MFCD00044400 InChI Key: PAORVUMOXXAMPL-VIFPVBQESA-N Synonym: (R)-(-)-MTPA-Cl; Mosher's acid chloride IUPAC Name: (2R)-3,3,3-trifluoro-2-methoxy-2-phenylpropanoyl chloride SMILES: CO[C@](C(Cl)=O)(C1=CC=CC=C1)C(F)(F)F

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Specifications

Molecular Weight (g/mol)	252.62
MDL Number	MFCD00044400
SMILES	CO[C@](C(Cl)=O)(C1=CC=CC=C1)C(F)(F)F
Synonym	(R)-(-)-MTPA-Cl; Mosher's acid chloride
IUPAC Name	(2R)-3,3,3-trifluoro-2-methoxy-2-phenylpropanoyl chloride
InChI Key	PAORVUMOXXAMPL-VIFPVBQESA-N
Molecular Formula	C10H8ClF3O2

1,566

Selectophore™ Dipentyl phthalate, 99.0%, MilliporeSigma™ Supelco™

CAS: 131-18-0 Molecular Formula: C18H26O4 Molecular Weight (g/mol): 306.40 MDL Number: MFCD00041934 InChI Key: IPKKHRVROFYTEK-UHFFFAOYSA-N IUPAC Name: 1,2-dipentyl benzene-1,2-dicarboxylate SMILES: CCCCCOC(=O)C1=CC=CC=C1C(=O)OCCCCC

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CAS	131-18-0
Molecular Weight (g/mol)	306.40
MDL Number	MFCD00041934
SMILES	CCCCCOC(=O)C1=CC=CC=C1C(=O)OCCCCC
IUPAC Name	1,2-dipentyl benzene-1,2-dicarboxylate
InChI Key	IPKKHRVROFYTEK-UHFFFAOYSA-N
Molecular Formula	C18H26O4

1,567

3-Chloroperoxybenzoic Acid, 70-75%, balance 3-Chlorobenzoic Acid and water

3-Chloroperoxybenzoic acid, 70-75%, C7H5ClO3, CAS Number-937-14-4, 535-80-8, 7732-18-5 | CAS: 937-14-4 | C7H5ClO3 | 172.56 g/mol

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Specifications

Linear Formula	ClC₆H₄CO₃H
Molecular Weight (g/mol)	172.56
ChEBI	CHEBI:52091
CAS Min %	25.0
InChI Key	NHQDETIJWKXCTC-UHFFFAOYSA-N
Density	0.5600g/mL
PubChem CID	70297
Name Note	70 - 75%
Percent Purity	70-75%
Fieser	01,135; 02,68; 03,49; 04,85; 05,120; 06,110; 07,62; 08,97; 09,108; 10,92; 11,122; 12,118; 13,76; 15,86; 16,80; 17,76
RTECS Number	SD9470000
Formula Weight	172.57
Melting Point	92.0°C to 94.0°C
CAS Max %	30.0
Color	White
Physical Form	Moist Powder
SMILES	OOC(=O)C1=CC=CC(Cl)=C1
Merck Index	15,2154
Assay Percent Range	di-m-Chlorobenzoyl peroxide: < 0.1% Typical (HPLC)
CAS	7732-18-5
Health Hazard 3	GHS P Statement Wear protective gloves/protective clothing/eye protection/face protection. Keep away from heat/sparks/open flames/hot surfaces. - No smoking. Keep/Store away from clothing/ combustible materials. IF SWALLOWED: rin
MDL Number	MFCD00002127
Health Hazard 2	GHS H Statement Causes severe skin burns and eye damage. Harmful if swallowed. Heating may cause a fire.
Solubility Information	Solubility in water: insoluble. Other solubilities: soluble in koh, soluble in chloroform and acetone
Health Hazard 1	GHS Signal Word: Danger
Synonym	3-chloroperoxybenzoic acid,3-chloroperbenzoic acid,mcpba,m-chloroperbenzoic acid,m-chloroperoxybenzoic acid,meta-chloroperoxybenzoic acid,benzenecarboperoxoic acid, 3-chloro,m-chlorobenzoyl hydroperoxide,meta-chloroperbenzoic acid,3-chlorobenzoperoxoic acid
TSCA	TSCA
IUPAC Name	3-chlorobenzenecarboperoxoic acid
Beilstein	09,IV,972
Molecular Formula	C7H5ClO3
EINECS Number	213-322-3
Specific Gravity	0.56

1,568

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4,4'-Dichlorodiphenyl sulfone, 97%

CAS: 80-07-9 Molecular Formula: C12H8Cl2O2S Molecular Weight (g/mol): 287.15 MDL Number: MFCD00000619 InChI Key: GPAPPPVRLPGFEQ-UHFFFAOYSA-N Synonym: 4,4'-dichlorodiphenyl sulfone,bis 4-chlorophenyl sulfone,p,p'-dichlorodiphenyl sulfone,sulfone, bis p-chlorophenyl,4-chlorophenyl sulfone,1,1'-sulfonylbis 4-chlorobenzene,bis p-chlorophenyl sulfone,benzene, 1,1'-sulfonylbis 4-chloro,p-chlorophenyl sulfone,4,4'-dichlorodiphenylsulfone PubChem CID: 6625 IUPAC Name: 1-chloro-4-(4-chlorophenyl)sulfonylbenzene SMILES: ClC1=CC=C(C=C1)S(=O)(=O)C1=CC=C(Cl)C=C1

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PubChem CID	6625
CAS	80-07-9
Molecular Weight (g/mol)	287.15
MDL Number	MFCD00000619
SMILES	ClC1=CC=C(C=C1)S(=O)(=O)C1=CC=C(Cl)C=C1
Synonym	4,4'-dichlorodiphenyl sulfone,bis 4-chlorophenyl sulfone,p,p'-dichlorodiphenyl sulfone,sulfone, bis p-chlorophenyl,4-chlorophenyl sulfone,1,1'-sulfonylbis 4-chlorobenzene,bis p-chlorophenyl sulfone,benzene, 1,1'-sulfonylbis 4-chloro,p-chlorophenyl sulfone,4,4'-dichlorodiphenylsulfone
IUPAC Name	1-chloro-4-(4-chlorophenyl)sulfonylbenzene
InChI Key	GPAPPPVRLPGFEQ-UHFFFAOYSA-N
Molecular Formula	C12H8Cl2O2S

1,569

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1,2-Bis(diphenylphosphino)benzene, 98%

CAS: 13991-08-7 Molecular Formula: C30H24P2 Molecular Weight (g/mol): 446.47 MDL Number: MFCD00014081 InChI Key: NFRYVRNCDXULEX-UHFFFAOYSA-N Synonym: 1,2-bis diphenylphosphino benzene,dppbz,dppbe,dppben,dppbenz,o-bis diphenylphosphino benzene,1,2-bis dimethylphosphino benzene,o-phenylenebis diphenylphosphine,phosphine, phenylenebis diphenyl,1,2-bis diphenylphosphanyl benzene PubChem CID: 498379 IUPAC Name: (2-diphenylphosphanylphenyl)-diphenylphosphane SMILES: C1=CC=C(C=C1)P(C1=CC=CC=C1)C1=CC=CC=C1P(C1=CC=CC=C1)C1=CC=CC=C1

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PubChem CID	498379
CAS	13991-08-7
Molecular Weight (g/mol)	446.47
MDL Number	MFCD00014081
SMILES	C1=CC=C(C=C1)P(C1=CC=CC=C1)C1=CC=CC=C1P(C1=CC=CC=C1)C1=CC=CC=C1
Synonym	1,2-bis diphenylphosphino benzene,dppbz,dppbe,dppben,dppbenz,o-bis diphenylphosphino benzene,1,2-bis dimethylphosphino benzene,o-phenylenebis diphenylphosphine,phosphine, phenylenebis diphenyl,1,2-bis diphenylphosphanyl benzene
IUPAC Name	(2-diphenylphosphanylphenyl)-diphenylphosphane
InChI Key	NFRYVRNCDXULEX-UHFFFAOYSA-N
Molecular Formula	C30H24P2

1,570

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Phenylacetaldehyde, 98%, stabilized

CAS: 122-78-1 Molecular Formula: C8H8O Molecular Weight (g/mol): 120.15 MDL Number: MFCD00006993 InChI Key: DTUQWGWMVIHBKE-UHFFFAOYSA-N Synonym: phenylacetaldehyde,benzeneacetaldehyde,hyacinthin,alpha-tolualdehyde,phenylethanal,2-phenylethanal,phenylacetic aldehyde,alpha-toluic aldehyde,acetaldehyde, phenyl,benzylcarboxaldehyde PubChem CID: 998 ChEBI: CHEBI:16424 IUPAC Name: 2-phenylacetaldehyde SMILES: O=CCC1=CC=CC=C1

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PubChem CID	998
CAS	122-78-1
Molecular Weight (g/mol)	120.15
ChEBI	CHEBI:16424
MDL Number	MFCD00006993
SMILES	O=CCC1=CC=CC=C1
Synonym	phenylacetaldehyde,benzeneacetaldehyde,hyacinthin,alpha-tolualdehyde,phenylethanal,2-phenylethanal,phenylacetic aldehyde,alpha-toluic aldehyde,acetaldehyde, phenyl,benzylcarboxaldehyde
IUPAC Name	2-phenylacetaldehyde
InChI Key	DTUQWGWMVIHBKE-UHFFFAOYSA-N
Molecular Formula	C8H8O

1,571

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4,4'-Biphenyldicarboxylic acid, 98%

CAS: 787-70-2 Molecular Formula: C₁₄H₁₀O₄ Molecular Weight (g/mol): 242.23 MDL Number: MFCD00002554 InChI Key: NEQFBGHQPUXOFH-UHFFFAOYSA-N Synonym: biphenyl-4,4'-dicarboxylic acid,4,4'-biphenyldicarboxylic acid,1,1'-biphenyl-4,4'-dicarboxylic acid,4-4-carboxyphenyl benzoic acid,4,4'-bibenzoic acid,4,4'-diphenic acid,4,4'-dicarboxybiphenyl,p,p'-diphenic acid,usaf do-69,bibenzoic acid PubChem CID: 13084 IUPAC Name: 4-(4-carboxyphenyl)benzoic acid SMILES: C1=CC(=CC=C1C2=CC=C(C=C2)C(=O)O)C(=O)O

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PubChem CID	13084
CAS	787-70-2
Molecular Weight (g/mol)	242.23
MDL Number	MFCD00002554
SMILES	C1=CC(=CC=C1C2=CC=C(C=C2)C(=O)O)C(=O)O
Synonym	biphenyl-4,4'-dicarboxylic acid,4,4'-biphenyldicarboxylic acid,1,1'-biphenyl-4,4'-dicarboxylic acid,4-4-carboxyphenyl benzoic acid,4,4'-bibenzoic acid,4,4'-diphenic acid,4,4'-dicarboxybiphenyl,p,p'-diphenic acid,usaf do-69,bibenzoic acid
IUPAC Name	4-(4-carboxyphenyl)benzoic acid
InChI Key	NEQFBGHQPUXOFH-UHFFFAOYSA-N
Molecular Formula	C₁₄H₁₀O₄

1,572

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Acetone, Electronic/Cleanroom Grade, 99.5%, Spectrum™ Chemical

CAS: 67-64-1 Molecular Formula: C3H6O Molecular Weight (g/mol): 58.08 MDL Number: MFCD00008765 InChI Key: CSCPPACGZOOCGX-UHFFFAOYSA-N IUPAC Name: propan-2-one SMILES: CC(C)=O

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Specifications

CAS	67-64-1
Molecular Weight (g/mol)	58.08
MDL Number	MFCD00008765
SMILES	CC(C)=O
IUPAC Name	propan-2-one
InChI Key	CSCPPACGZOOCGX-UHFFFAOYSA-N
Molecular Formula	C3H6O

1,573

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alpha-Methylstyrene, 99%, stab. with 10-20 ppm 4-tert-butylcatechol

CAS: 98-83-9 Molecular Formula: C9H10 Molecular Weight (g/mol): 118.18 MDL Number: MFCD00008859 InChI Key: XYLMUPLGERFSHI-UHFFFAOYSA-N Synonym: alpha-methylstyrene,2-phenylpropene,2-phenyl-1-propene,isopropenylbenzene,benzene, 1-methylethenyl,2-phenylpropylene,1-methyl-1-phenylethylene,alpha-methylstyrol,as-methylphenylethylene,1-phenyl-1-methylethylene PubChem CID: 7407 ChEBI: CHEBI:35060 IUPAC Name: prop-1-en-2-ylbenzene SMILES: CC(=C)C1=CC=CC=C1

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PubChem CID	7407
CAS	98-83-9
Molecular Weight (g/mol)	118.18
ChEBI	CHEBI:35060
MDL Number	MFCD00008859
SMILES	CC(=C)C1=CC=CC=C1
Synonym	alpha-methylstyrene,2-phenylpropene,2-phenyl-1-propene,isopropenylbenzene,benzene, 1-methylethenyl,2-phenylpropylene,1-methyl-1-phenylethylene,alpha-methylstyrol,as-methylphenylethylene,1-phenyl-1-methylethylene
IUPAC Name	prop-1-en-2-ylbenzene
InChI Key	XYLMUPLGERFSHI-UHFFFAOYSA-N
Molecular Formula	C9H10

1,574

4-[2-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)benzyl]morpholine, 95%, Thermo Scientific™

CAS: 876316-33-5 Molecular Formula: C17H26BNO3 Molecular Weight (g/mol): 303.21 MDL Number: MFCD07781208 InChI Key: WCNXVDLZTGODQW-UHFFFAOYSA-N Synonym: 4-2-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl benzyl morpholine,2-4-morpholinomethyl phenylboronic acid pinacol ester,2-morpholinomethyl phenylboronic acid pinacol ester,2-morpholinomethyl phenylboronic acid, pinacol ester,4-2-tetramethyl-1,3,2-dioxaborolan-2-yl phenyl methyl morpholine,2-4-morpholinylmethyl benzeneboronic acid pinacol ester,4-2-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl phenyl methyl morpholine,amtb374,2-morpholin-4-ylmethyl benzeneboronic acid, pinacol ester PubChem CID: 16414146 IUPAC Name: 4-[[2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]methyl]morpholine SMILES: CC1(C)OB(OC1(C)C)C1=CC=CC=C1CN1CCOCC1

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PubChem CID	16414146
CAS	876316-33-5
Molecular Weight (g/mol)	303.21
MDL Number	MFCD07781208
SMILES	CC1(C)OB(OC1(C)C)C1=CC=CC=C1CN1CCOCC1
Synonym	4-2-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl benzyl morpholine,2-4-morpholinomethyl phenylboronic acid pinacol ester,2-morpholinomethyl phenylboronic acid pinacol ester,2-morpholinomethyl phenylboronic acid, pinacol ester,4-2-tetramethyl-1,3,2-dioxaborolan-2-yl phenyl methyl morpholine,2-4-morpholinylmethyl benzeneboronic acid pinacol ester,4-2-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl phenyl methyl morpholine,amtb374,2-morpholin-4-ylmethyl benzeneboronic acid, pinacol ester
IUPAC Name	4-[[2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]methyl]morpholine
InChI Key	WCNXVDLZTGODQW-UHFFFAOYSA-N
Molecular Formula	C17H26BNO3

1,575

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Sodium Salicylate, Crystal, USP, 98-102%, Spectrum™ Chemical

CAS: 54-21-7 Molecular Formula: C7H5NaO3 Molecular Weight (g/mol): 160.10 InChI Key: ABBQHOQBGMUPJH-UHFFFAOYSA-M IUPAC Name: sodium 2-hydroxybenzoate SMILES: [Na+].OC1=CC=CC=C1C([O-])=O

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CAS	54-21-7
Molecular Weight (g/mol)	160.10
SMILES	[Na+].OC1=CC=CC=C1C([O-])=O
IUPAC Name	sodium 2-hydroxybenzoate
InChI Key	ABBQHOQBGMUPJH-UHFFFAOYSA-M
Molecular Formula	C7H5NaO3

Benzene and substituted derivatives

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