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Reference substances

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IUPAC name:
3,5,5-trimethylhexan-1-ol

Inventory

EC number:
222-376-7
EC name:
3,5,5-trimethylhexan-1-ol
CAS number:
3452-97-9
CAS number:
3452-97-9
Synonyms
Names:
1-Hexanol, 3,5,5-trimethyl-
Isononanol
Identifier:
IUPAC name
3,5,5-Trimethyl-1-hexanol
Identifier:
other: SMILES notation
CC(CCO)CC(C)(C)C
Identifier:
other: InChl
InChI=1/C9H20O/c1-8(5-6-10)7-9(2,3)4/h8,10H,5-7H2,1-4H3
Identifier:
other: InChl
InChI=1S/C9H20O/c1-8(5-6-10)7-9(2,3)4/h8,10H,5-7H2,1-4H3
Identifier:
other: SMILES notation
OCCC(C)CC(C)(C)C
3,5,5-trimethylhexan-1-ol

Molecular and structural information

Molecular formula:
C9H20O
Molecular weight:
144.255
SMILES notation:
CC(C)CCCCCCO
InChl:
InChI=1/C9H20O/c1-9(2)7-5-3-4-6-8-10/h9-10H,3-8H2,1-2H3
Structural formula:
Chemical structure

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