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6-benzyloxy-2,2-dimethyl-2H-chromen (HCID 10901546)|Huagongshe
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Compound
6-benzyloxy-2,2-dimethyl-2H-chromen
HCID
10901546
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Basic information
Names & identifiers
Properties
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Compound notes
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Basic information
Standard SMILES
CC1(C)C=Cc2cc(OCc3ccccc3)ccc2O1
InChIKey
BHGVPSZXUWUINH-UHFFFAOYSA-N
Molecular formula
C18H18O2
Average molar mass
266.3 g/mol
Monoisotopic mass
266.13067981
Names & identifiers
Preferred name
6-benzyloxy-2,2-dimethyl-2H-chromen
IUPAC
2,2-dimethyl-6-phenylmethoxychromene
Names & synonyms
SCHEMBL6936669
BHGVPSZXUWUINH-UHFFFAOYSA-N
6-benzyloxy-2,2-dimethyl-2H-chromen
Database identifiers
PubChem CID
10901546
Properties
Computed structural properties
XLogP
4.3
Topological polar surface area
18.5 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
3
Heavy atoms
20
Formal charge
0
Complexity
341
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Related reactions
2 records
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As reactant
As product
As reagent
As catalyst
As solvent
HRID
114799
As product
Training data from https://doi.org/10.1039/C8SC04228D (2/10)
HRID
613436
As product
uspto-grants-1999_12
Compound notes
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