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Structure

7-Benzyl-O-esculetin

CAS
895-61-4
Catalog Number
ACM895614
Category
Other Products
Molecular Weight
268.26
Molecular Formula
C16H12O4

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Specification

Synonyms
7-Benzyl-O-esculetin;7-Benzyloxy-6-hydroxycoumarin
IUPAC Name
6-hydroxy-7-phenylmethoxychromen-2-one
Canonical SMILES
C1=CC=C(C=C1)COC2=C(C=C3C=CC(=O)OC3=C2)O
InChI Key
QKMATZIOKUNXOE-UHFFFAOYSA-N
Boiling Point
503.8ºC at 760 mmHg
Flash Point
193.7ºC
Density
1.339 g/cm³
Exact Mass
268.07400
H-Bond Acceptor
4
H-Bond Donor
1
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