Chemical Name: 3-Butyn-2-ol, 2-methyl-
IUPAC Name: 2-methylbut-3-yn-2-ol
CAS RN: 115-19-5
Description: single chemical compound
STRUCTURE Formula: C5H8O
Molecular Weight: 84.1164
SMILES: CC(O)(C)C#C
Note:
Chemical Name: Silane, trichloroethyl-
IUPAC Name: trichloro(ethyl)silane
CAS RN: 115-21-9
Description: single chemical compound
STRUCTURE Formula: C2H5Cl3Si
Molecular Weight: 163.5056
SMILES: Cl[Si](Cl)(CC)Cl
Note:
Chemical Name: 4,7-Methanoisobenzofuran-1,3-dione, 4,5,6,7,8,8-hexachloro-3a,4,7,7a-tetrahydro-
IUPAC Name: 4,5,6,7,8,8-hexachloro-3a,4,7,7a-tetrahydro-4,7-methano-2-benzofuran-1,3-dione
CAS RN: 115-27-5
Description: single chemical compound
STRUCTURE Formula: C9H2Cl6O3
Molecular Weight: 370.8284
SMILES: O=C1C2C(C3(Cl)C(Cl)=C(Cl)C(Cl)2C(Cl)3Cl)C(O1)=O
Note: stereochem
Chemical Name: Bicyclo[2.2.1]hept-5-ene-2,3-dicarboxylic acid, 1,4,5,6,7,7-hexachloro-
IUPAC Name: 1,4,5,6,7,7-hexachlorobicyclo[2.2.1]hept-5-ene-2,3-dicarboxylic acid
CAS RN: 115-28-6
Description: single chemical compound
STRUCTURE Formula: C9H4Cl6O4
Molecular Weight: 388.8437
SMILES: ClC2(Cl)C1(Cl)C(Cl)=C(Cl)C2(Cl)C(C1C(O)=O)C(O)=O
Note: stereochem
Chemical Name: 1,3-Propanediol, 2,2-bis(hydroxymethyl)-
IUPAC Name: pentaerythritol
CAS RN: 115-77-5
Description: single chemical compound
STRUCTURE Formula: C5H12O4
Molecular Weight: 136.1464
SMILES: OCC(CO)(CO)CO
Note:
Chemical Name: Octadecanoic acid, 2,2-bis[[(1-oxooctadecyl)oxy]methyl]-1,3-propanediyl ester
IUPAC Name: pentaerythrityl tetrastearate
CAS RN: 115-83-3
Description: single chemical compound
STRUCTURE Formula: C77H148O8
Molecular Weight: 1201.9942
SMILES: O=C(CCCCCCCCCCCCCCCCC)OCC(COC(CCCCCCCCCCCCCCCCC)=O)(COC(CCCCCCCCCCCCCCCCC)=O)COC(CCCCCCCCCCCCCCCCC)=O
Note:
Chemical Name: Phosphoric acid, triphenyl ester
IUPAC Name: triphenyl phosphate
CAS RN: 115-86-6
Description: single chemical compound
STRUCTURE Formula: C18H15O4P
Molecular Weight: 326.2831
SMILES: C1=CC=CC=C1OP(=O)(OC2=CC=CC=C2)OC3=CC=CC=C3
Note:
Chemical Name: 1,6-Octadien-3-ol, 3,7-dimethyl-, acetate
IUPAC Name: 1,5-dimethyl-1-vinylhex-4-en-1-yl acetate
CAS RN: 115-95-7
Description: single chemical compound
STRUCTURE Formula: C12H20O2
Molecular Weight: 196.286
SMILES: O=C(C)OC(CCC=C(C)/C)(C)C=C
Note:
Chemical Name: Ethanol, 2-chloro-, phosphate (3:1)
IUPAC Name: tris(2-chloroethyl) phosphate
CAS RN: 115-96-8
Description: single chemical compound
STRUCTURE Formula: C6H12Cl3O4P
Molecular Weight: 285.4898
SMILES: O=P(OCCCl)(OCCCl)OCCCl
Note:
Chemical Name: Ethene, tetrafluoro-
IUPAC Name: tetrafluoroethene
CAS RN: 116-14-3
Description: single chemical compound
STRUCTURE Formula: C2F4
Molecular Weight: 100.015
SMILES: F/C(F)=C(F)F
Note:
Chemical Name: 1-Propene, 1,1,2,3,3,3-hexafluoro-
IUPAC Name: 1,1,2,3,3,3-hexafluoroprop-1-ene
CAS RN: 116-15-4
Description: single chemical compound
STRUCTURE Formula: C3F6
Molecular Weight: 150.0225
SMILES: FC(F)=C(F)/C(F)(F)F
Note:
Chemical Name: Butanoic acid, 2-methyl-
IUPAC Name: 2-methylbutanoic acid
CAS RN: 116-53-0
Description: single chemical compound
STRUCTURE Formula: C5H10O2
Molecular Weight: 102.1317
SMILES: CC(CC)C(O)=O
Note:
Chemical Name: 1,3-Isobenzofurandione, 4,5,6,7-tetrachloro-
IUPAC Name: 4,5,6,7-tetrachloro-2-benzofuran-1,3-dione
CAS RN: 117-08-8
Description: single chemical compound
STRUCTURE Formula: C8Cl4O3
Molecular Weight: 285.8958
SMILES: O=C(OC(=O)c1c(c(c(c2Cl)Cl)Cl)Cl)c12
Note:
Chemical Name: 1,2-Benzenedicarboxylic acid, bis(2-ethylhexyl) ester
IUPAC Name: bis(2-ethylhexyl) phthalate
CAS RN: 117-81-7
Description: single chemical compound
STRUCTURE Formula: C24H38O4
Molecular Weight: 390.5561
SMILES: O=C(C1=C(C=CC=C1)C(=O)OCC(CCCC)CC)OCC(CCCC)CC
Note:
Chemical Name: 1,2-Benzenedicarboxylic acid, dioctyl ester
IUPAC Name: dioctyl phthalate
CAS RN: 117-84-0
Description: single chemical compound
STRUCTURE Formula: C24H38O4
Molecular Weight: 390.5561
SMILES: CCCCCCCCOC(=O)C1=CC=CC=C1C(=O)OCCCCCCCC
Note:
Chemical Name: 1H-Isoindole-1,3(2H)-dione, 2-(hydroxymethyl)-
IUPAC Name: 2-(hydroxymethyl)-1H-isoindole-1,3(2H)-dione
CAS RN: 118-29-6
Description: single chemical compound
STRUCTURE Formula: C9H7NO3
Molecular Weight: 177.1568
SMILES: O=C1C2=C(C=CC=C2)C(N1CO)=O
Note:
Chemical Name: 2H-3,1-Benzoxazine-2,4(1H)-dione
IUPAC Name: 2H-3,1-benzoxazine-2,4(1H)-dione
CAS RN: 118-48-9
Description: single chemical compound
STRUCTURE Formula: C8H5NO3
Molecular Weight: 163.1302
SMILES: O=C(O1)NC(C=CC=C2)=C2C1=O
Note:
Chemical Name: Benzoic acid, 2-hydroxy-, phenylmethyl ester
IUPAC Name: benzyl salicylate
CAS RN: 118-58-1
Description: single chemical compound
STRUCTURE Formula: C14H12O3
Molecular Weight: 228.2433
SMILES: O=C(OCc1ccccc1)c2ccccc2O
Note:
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