Chemical Name: Phenol, 2-(2H-benzotriazol-2-yl)-4-(1,1,3,3-tetramethylbutyl)-
IUPAC Name: 2-(2H-benzotriazol-2-yl)-4-(1,1,3,3-tetramethylbutyl)phenol
CAS RN: 3147-75-9
Description: single chemical compound
STRUCTURE Formula: C20H25N3O
Molecular Weight: 323.432
SMILES: OC1=C(N2N=C(C=CC=C3)C3=N2)C=C(C(C)(C)CC(C)(C)C)C=C1
Note:
Chemical Name: D-Glucopyranoside, methyl
IUPAC Name: methyl D-glucopyranoside
CAS RN: 3149-68-6
Description: single chemical compound
STRUCTURE Formula: C7H14O6
Molecular Weight: 194.1825
SMILES: O[C@H]([C@H]([C@@H]([C@@H](CO)O1)O)O)C1OC
Note: stereochem, same 2 D structure [97-30-3]
Chemical Name: Octadecanoic acid, 12-hydroxy-, calcium salt (2:1)
IUPAC Name: calcium bis(12-hydroxyoctadecanoate)
CAS RN: 3159-62-4
Description: single chemical compound
STRUCTURE Formula: C36H70CaO6
Molecular Weight: 639.0154
SMILES: O=C([O-])CCCCCCCCCCC(O)CCCCCC.O=C([O-])CCCCCCCCCCC(O)CCCCCC.[Ca+2]
Note: parent [106-14-9]
Chemical Name: Hexanoic acid, 2-ethyl-, potassium salt
IUPAC Name: potassium 2-ethylhexanoate
CAS RN: 3164-85-0
Description: single chemical compound
STRUCTURE Formula: C8H15KO2
Molecular Weight: 182.3018
SMILES: O=C([O-])C(CC)CCCC.[K+]
Note: parent [149-57-5]
Chemical Name: Cyclohexane, isocyanato-
IUPAC Name: isocyanatocyclohexane
CAS RN: 3173-53-3
Description: single chemical compound
STRUCTURE Formula: C7H11NO
Molecular Weight: 125.1683
SMILES: N(=C=O)C1CCCCC1
Note:
Chemical Name: Cyclododecane, 1,2,5,6,9,10-hexabromo-
IUPAC Name: 1,2,5,6,9,10-hexabromocyclododecane
CAS RN: 3194-55-6
Description: single chemical compound
STRUCTURE Formula: C12H18Br6
Molecular Weight: 641.6953
SMILES: BrC1C(Br)CCC(Br)C(Br)CCC(Br)C(Br)CC1
Note:
Chemical Name: Propanal, 3-(methylthio)-
IUPAC Name: 3-(methylthio)propanal
CAS RN: 3268-49-3
Description: single chemical compound
STRUCTURE Formula: C4H8OS
Molecular Weight: 104.1707
SMILES: O=CCCSC
Note:
Chemical Name: Propanoyl chloride, 2,2-dimethyl-
IUPAC Name: 2,2-dimethylpropanoyl chloride
CAS RN: 3282-30-2
Description: single chemical compound
STRUCTURE Formula: C5H9ClO
Molecular Weight: 120.5774
SMILES: ClC(C(C)(C)C)=O
Note:
Chemical Name: 2-Propenoic acid, 2-methyl-, 2-ethyl-2-[[(2-methyl-1-oxo-2-propenyl)oxy]methyl]-1,3-propanediyl ester
IUPAC Name: 2,2-Bis(methacryloyloxymethyl)butyl methacrylate
CAS RN: 3290-92-4
Description: single chemical compound
STRUCTURE Formula: C18H26O6
Molecular Weight: 338.3954
SMILES: O=C(C(C)=C)OCC(COC(C(C)=C)=O)(COC(C(C)=C)=O)CC
Note:
Chemical Name: 1,3-Propanediol, 2,2-bis(bromomethyl)-
IUPAC Name: 2,2-bis(bromomethyl)propane-1,3-diol
CAS RN: 3296-90-0
Description: single chemical compound
STRUCTURE Formula: C5H10Br2O2
Molecular Weight: 261.9397
SMILES: OCC(CO)(CBr)CBr
Note:
Chemical Name: 1,2,4-Benzenetricarboxylic acid, tris(2-ethylhexyl) ester
IUPAC Name: Tris(2-ethylhexyl) benzene-1,2,4-tricarboxylate
CAS RN: 3319-31-1
Description: single chemical compound
STRUCTURE Formula: C33H54O6
Molecular Weight: 546.7783
SMILES: O=C(OCC(CCCC)CC)c(ccc(c1C(=O)OCC(CCCC)CC)C(=O)OCC(CCCC)CC)c1
Note:
Chemical Name: Hexanedioic acid, compd. with 1,6-hexanediamine (1:1)
IUPAC Name: hexanedioic acid - hexane-1,6-diamine (1:1)
CAS RN: 3323-53-3
Description: single chemical compound
STRUCTURE Formula: C12H26N2O4
Molecular Weight: 262.3458
SMILES: O=C(CCCCC(O)=O)O.NCCCCCCN
Note:
Chemical Name: 1-Propanaminium, 3-chloro-2-hydroxy-N,N,N-trimethyl-, chloride
IUPAC Name: 3-chloro-2-hydroxy-N,N,N-trimethylpropan-1-aminium chloride
CAS RN: 3327-22-8
Description: single chemical compound
STRUCTURE Formula: C6H15Cl2NO
Molecular Weight: 188.0954
SMILES: ClCC(O)C[N+](C)(C)C.[Cl-]
Note: ammonium
Chemical Name: Phosphorodithioic acid, O,O-diethyl ester, sodium salt
IUPAC Name: sodium O,O-diethyl dithiophosphate
CAS RN: 3338-24-7
Description: single chemical compound
STRUCTURE Formula: C4H10NaO2PS2
Molecular Weight: 208.2145
SMILES: S=P(OCC)([S-])OCC.[Na+]
Note: parent [298-06-6]
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