CAS
99175-40-3 Purity
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99175-40-3 Purity
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4-Methoxy-1,3-benzenediol 3-Acetate
CAS
99179-72-3
Catalog Number
ACM99179723
Category
Other Products
Molecular Weight
182.17
Molecular Formula
C9H10O4
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Specification
Synonyms
4-Methoxy-resorcinol 3-Acetate; 4-Methoxy-1,3-benzenediol 3-Acetate
IUPAC Name
(5-hydroxy-2-methoxyphenyl) acetate
Canonical SMILES
CC(=O)OC1=C(C=CC(=C1)O)OC
InChI Key
HQRTWUHDOCDAJQ-UHFFFAOYSA-N
Appearance
Off-White Solid
Exact Mass
182.05800
H-Bond Acceptor
4
H-Bond Donor
1
What is the molecular formula of 4-Methoxy-1,3-benzenediol 3-Acetate?
The molecular formula of 4-Methoxy-1,3-benzenediol 3-Acetate is C9H10O4.
What is the molecular weight of 4-Methoxy-1,3-benzenediol 3-Acetate?
The molecular weight of 4-Methoxy-1,3-benzenediol 3-Acetate is 182.17 g/mol.
What is the IUPAC name of 4-Methoxy-1,3-benzenediol 3-Acetate?
The IUPAC name of 4-Methoxy-1,3-benzenediol 3-Acetate is (5-hydroxy-2-methoxyphenyl) acetate.
What is the InChI of 4-Methoxy-1,3-benzenediol 3-Acetate?
The InChI of 4-Methoxy-1,3-benzenediol 3-Acetate is InChI=1S/C9H10O4/c1-6(10)13-9-5-7(11)3-4-8(9)12-2/h3-5,11H,1-2H3.
What is the InChIKey of 4-Methoxy-1,3-benzenediol 3-Acetate?
The InChIKey of 4-Methoxy-1,3-benzenediol 3-Acetate is HQRTWUHDOCDAJQ-UHFFFAOYSA-N.
What is the canonical SMILES of 4-Methoxy-1,3-benzenediol 3-Acetate?
The canonical SMILES of 4-Methoxy-1,3-benzenediol 3-Acetate is CC(=O)OC1=C(C=CC(=C1)O)OC.
What is the CAS number of 4-Methoxy-1,3-benzenediol 3-Acetate?
The CAS number of 4-Methoxy-1,3-benzenediol 3-Acetate is 99179-72-3.
What is the hydrogen bond donor count of 4-Methoxy-1,3-benzenediol 3-Acetate?
The hydrogen bond donor count of 4-Methoxy-1,3-benzenediol 3-Acetate is 1.
What is the hydrogen bond acceptor count of 4-Methoxy-1,3-benzenediol 3-Acetate?
The hydrogen bond acceptor count of 4-Methoxy-1,3-benzenediol 3-Acetate is 4.
Is 4-Methoxy-1,3-benzenediol 3-Acetate a canonicalized compound?
Yes, 4-Methoxy-1,3-benzenediol 3-Acetate is canonicalized.
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