Chemical Name: 7-Oxabicyclo[4.1.0]heptane
IUPAC Name: 7-oxabicyclo[4.1.0]heptane
CAS RN: 286-20-4
Description: single chemical compound
STRUCTURE Formula: C6H10O
Molecular Weight: 98.143
SMILES: O(C1CCCC2)C12
Note:
Chemical Name: Acetyl chloride, trifluoro-
IUPAC Name: trifluoroacetyl chloride
CAS RN: 354-32-5
Description: single chemical compound
STRUCTURE Formula: C2ClF3O
Molecular Weight: 132.469
SMILES: ClC(C(F)(F)F)=O
Note:
Chemical Name: Oxirane, trifluoro(trifluoromethyl)-
IUPAC Name: 2,2,3-trifluoro-3-(trifluoromethyl)oxirane
CAS RN: 428-59-1
Description: single chemical compound
STRUCTURE Formula: C3F6O
Molecular Weight: 166.0219
SMILES: FC1(F)OC(C(F)(F)F)1F
Note:
Chemical Name: 1,2-Propadiene
IUPAC Name: allene
CAS RN: 463-49-0
Description: single chemical compound
STRUCTURE Formula: C3H4
Molecular Weight: 40.0639
SMILES: C=C=C
Note:
Chemical Name: Propane, 2,2-dimethyl-
IUPAC Name: neopentane
CAS RN: 463-82-1
Description: single chemical compound
STRUCTURE Formula: C5H12
Molecular Weight: 72.1488
SMILES: CC(C)(C)C
Note:
Chemical Name: Bicyclo[3.1.1]heptan-2-ol, 2,6,6-trimethyl-
IUPAC Name: 2,6,6-trimethylbicyclo[3.1.1]heptan-2-ol
CAS RN: 473-54-1
Description: single chemical compound
STRUCTURE Formula: C10H18O
Molecular Weight: 154.2493
SMILES: OC1(C)C(C2)C(C)(C)C2CC1
Note: mixture of steroisomers; structure shown without stereochem; replicate 2D structure [4948-28-1]; [4948-29-2]
Chemical Name: Bicyclo[3.1.1]heptane, 2,6,6-trimethyl-
IUPAC Name: 2,6,6-trimethylbicyclo[3.1.1]heptane
CAS RN: 473-55-2
Description: single chemical compound
STRUCTURE Formula: C10H18
Molecular Weight: 138.2499
SMILES: CC2(C)C1CC2C(C)CC1
Note:
Chemical Name: Butanoic acid, 3-methyl-
IUPAC Name: 3-methylbutanoic acid
CAS RN: 503-74-2
Description: single chemical compound
STRUCTURE Formula: C5H10O2
Molecular Weight: 102.1317
SMILES: O=C(O)CC(C)C
Note:
Chemical Name: 1,3-Dioxepane
IUPAC Name: 1,3-dioxepane
CAS RN: 505-65-7
Description: single chemical compound
STRUCTURE Formula: C5H10O2
Molecular Weight: 102.1317
SMILES: O1COCCCC1
Note:
Chemical Name: Benzenesulfonic acid, 4-amino-, monosodium salt
IUPAC Name: sodium 4-aminobenzenesulfonate
CAS RN: 515-74-2
Description: single chemical compound
STRUCTURE Formula: C6H6NNaO3S
Molecular Weight: 195.1715
SMILES: O=S(C1=CC=C(N)C=C1)([O-])=O.[Na+]
Note: parent [121-57-3]
Chemical Name: Benzene, 1,2,3,5-tetramethyl-
IUPAC Name: 1,2,3,5-tetramethylbenzene
CAS RN: 527-53-7
Description: single chemical compound
STRUCTURE Formula: C10H14
Molecular Weight: 134.2182
SMILES: Cc1c(C)cc(C)cc1C
Note:
Chemical Name: 1,3,5-Triazine-2,4-diamine, 6-methyl-
IUPAC Name: 6-methyl-1,3,5-triazine-2,4-diamine
CAS RN: 542-02-9
Description: single chemical compound
STRUCTURE Formula: C4H7N5
Molecular Weight: 125.1319
SMILES: NC1=NC(C)=NC(N)=N1
Note:
Chemical Name: Naphthalene, 2,6-dimethyl-
IUPAC Name: 2,6-dimethylnaphthalene
CAS RN: 581-42-0
Description: single chemical compound
STRUCTURE Formula: C12H12
Molecular Weight: 156.2237
SMILES: CC1=CC(C=CC(C)=C2)=C2C=C1
Note:
Chemical Name: 1-Triacontanol
IUPAC Name: triacontan-1-ol
CAS RN: 593-50-0
Description: single chemical compound
STRUCTURE Formula: C30H62O
Molecular Weight: 438.8127
SMILES: OCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC
Note:
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