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(Q83075659)
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English
3-(4-Methoxyphenyl)propan-1-ol
chemical compound
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No label defined
No description defined
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
166.099379688
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₀H₁₄O₂
0 references
canonical SMILES
COC1=CC=C(C=C1)CCCO
0 references
Identifiers
InChI
InChI=1S/C10H14O2/c1-12-10-6-4-9(5-7-10)3-2-8-11/h4-7,11H,2-3,8H2,1H3
0 references
InChIKey
NIIDHUCLROLCBU-UHFFFAOYSA-N
0 references
CAS Registry Number
5406-18-8
1 reference
InChIKey
NIIDHUCLROLCBU-UHFFFAOYSA-N
stated in
CAS Common Chemistry
retrieved
10 April 2021
reference URL
https://commonchemistry.cas.org/detail?cas_rn=5406-18-8
PubChem CID
79406
1 reference
matched by identifier from
InChIKey
InChIKey
NIIDHUCLROLCBU-UHFFFAOYSA-N
ChEBI ID
168467
mapping relation type
exact match
2 references
stated in
ChEBI release 2022-06-13
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C10H14O2/c1-12-10-6-4-9(5-7-10)3-2-8-11/h4-7,11H,2-3,8H2,1H3
SureChEMBL ID
SCHEMBL79113
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
NIIDHUCLROLCBU-UHFFFAOYSA-N
UniChem compound ID
9945570
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID20202382
1 reference
matched by identifier from
InChIKey
InChIKey
NIIDHUCLROLCBU-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID20124873
0 references
NSC number
5311
0 references
FL number
02.173
1 reference
quotation
CAS no.: 5406-18-8
(English)
stated in
EFSA database
retrieved
23 January 2021
FL number
02.173
UNII
S9PVU97PBV
1 reference
matched by identifier from
InChIKey
InChIKey
NIIDHUCLROLCBU-UHFFFAOYSA-N
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