Chemical Name: 4,7-Methanoisobenzofuran-1,3-dione, 3a,4,7,7a-tetrahydromethyl-, (3aR,4S,7R,7aS)-rel-
IUPAC Name: (3aR,4S,7R)-3a-methyl-3a,4,7,7a-tetrahydro-4,7-methano-2-benzofuran-1,3-dione
CAS RN: 25134-21-8
Description: single chemical compound
STRUCTURE Formula: C10H10O3
Molecular Weight: 178.1846
SMILES: O=C(C2[C@](C)1[C@@H]3C=C[C@H]2C3)OC1=O
Note: stereochem
Chemical Name: Piperazineethanol
IUPAC Name: 2-piperazin-2-ylethanol
CAS RN: 25154-38-5
Description: single chemical compound
STRUCTURE Formula: C6H14N2O
Molecular Weight: 130.1882
SMILES: OCCC1NCCNC1
Note:
Chemical Name: Phenol, nonyl-
IUPAC Name: 4-nonylphenol
CAS RN: 25154-52-3
Description: mixture or formulation
STRUCTURE Formula: C15H24O
Molecular Weight: 220.354
SMILES: CCCCCCCCCC1=CC=C(O)C=C1
Note: mixture of o-, m-, p- isomers structure shown p-
Chemical Name: Phenol, dimethyl-, phosphate (3:1)
IUPAC Name: tris(3,5-dimethylphenyl) phosphate
CAS RN: 25155-23-1
Description: mixture or formulation
STRUCTURE Formula: C24H27O4P
Molecular Weight: 410.4425
SMILES: Cc1cc(cc(C)c1)OP(=O)(Oc2cc(C)cc(C)c2)Oc3cc(C)cc(C)c3
Note: mixture of isomeric xylene phosphates, structure shown tris(3,5-dimethylphenyl) phosphate
Chemical Name: Peroxide, [1,3(or 1,4)-phenylenebis(1-methylethylidene)]bis[(1,1-dimethylethyl)
IUPAC Name: 1,4-bis[1-(tert-butylperoxy)-1-methylethyl]benzene
CAS RN: 25155-25-3
Description: mixture or formulation
STRUCTURE Formula: C20H34O4
Molecular Weight: 338.4816
SMILES: CC(C)(C)OOC(C)(C)c1ccc(cc1)C(C)(C)OOC(C)(C)C
Note: mixture of 1,3- and 1,4-bis[1-(tert-butylperoxy)-1-methylethyl]benzene, structure shown 1,4-
Chemical Name: Benzenesulfonic acid, dodecyl-, sodium salt
IUPAC Name: sodium 4-(1-ethyldecyl)benzenesulfonate
CAS RN: 25155-30-0
Description: mixture or formulation
STRUCTURE Formula: C18H29NaO3S
Molecular Weight: 348.4758
SMILES: O=S(C1=CC=C(C(CCCCCCCCC)CC)C=C1)([O-])=O.[Na+]
Note: mixture benzenesulfonate salts with the dodecyl chain attached at any but terminal C's; structure shown 3-; parent [27176-87-0]
Chemical Name: Butene
IUPAC Name: but-1-ene
CAS RN: 25167-67-3
Description: mixture or formulation
STRUCTURE Formula: C4H8
Molecular Weight: 56.1063
SMILES: CCC=C
Note: mixture of 1- [106-98-9] and 2-butene [107-01-7], structure shown 1-
Chemical Name: Pentene, 2,4,4-trimethyl-
IUPAC Name: 2,4,4-trimethylpent-1-ene
CAS RN: 25167-70-8
Description: mixture or formulation
STRUCTURE Formula: C8H16
Molecular Weight: 112.2126
SMILES: CC(C)(C)CC(C)=C
Note: mixture of 1- [107-39-1] and 2- [107-40-4] trimethylpentene, structure shown 1-
Chemical Name: Benzene, chloromethyl-
IUPAC Name: 1-chloro-3-methylbenzene
CAS RN: 25168-05-2
Description: mixture or formulation
STRUCTURE Formula: C7H7Cl
Molecular Weight: 126.5835
SMILES: ClC1=CC=CC(C)=C1
Note: mixture of 1-chloro-2-methyl [95-49-8], -3-methyl [108-41-8] and 4-methyl [106-43-4], structure shown 3-methyl
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