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English
4-(1,1-Dimethylheptyl)phenol
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
biogenic alkylphenol
1 reference
based on heuristic
inferred from SMILES
mass
220.182715388
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₅H₂₄O
0 references
canonical SMILES
CCCCCCC(C)(C)C1=CC=C(C=C1)O
0 references
Identifiers
InChI
InChI=1S/C15H24O/c1-4-5-6-7-12-15(2,3)13-8-10-14(16)11-9-13/h8-11,16H,4-7,12H2,1-3H3
0 references
InChIKey
IJWXCYSPVNCDMA-UHFFFAOYSA-N
0 references
CAS Registry Number
30784-30-6
1 reference
InChIKey
IJWXCYSPVNCDMA-UHFFFAOYSA-N
stated in
CAS Common Chemistry
retrieved
8 April 2021
reference URL
https://commonchemistry.cas.org/detail?cas_rn=30784-30-6
PubChem CID
3015513
1 reference
matched by identifier from
InChIKey
InChIKey
IJWXCYSPVNCDMA-UHFFFAOYSA-N
UniChem compound ID
26513117
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID90184803
1 reference
matched by identifier from
InChIKey
InChIKey
IJWXCYSPVNCDMA-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID90107294
0 references
Human Metabolome Database ID
HMDB0246130
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
IJWXCYSPVNCDMA-UHFFFAOYSA-N
UNII
3VLG3X8TCC
1 reference
matched by identifier from
InChIKey
InChIKey
IJWXCYSPVNCDMA-UHFFFAOYSA-N
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