CAS
939-17-3 Purity
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939-17-3 Purity
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4-Allyl-2-methoxyphenyl heptanoate
CAS
93917-74-9
Catalog Number
ACM93917749
Category
Other Products
Molecular Weight
276.370660 [g/mol]
Molecular Formula
C17H24O3
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Specification
Synonyms
4-Allyl-2-methoxyphenyl heptanoate, EINECS 299-853-1, 93917-74-9
IUPAC Name
(2-methoxy-4-prop-2-enylphenyl) heptanoate
InChI Key
SSZHJUHMUSGBLF-UHFFFAOYSA-N
Boiling Point
359.5ºC at 760mmHg
Flash Point
150ºC
Density
0.992g/cm³
Exact Mass
276.17300
H-Bond Acceptor
3
H-Bond Donor
0
What is the molecular formula of 4-Allyl-2-methoxyphenyl heptanoate?
The molecular formula of 4-Allyl-2-methoxyphenyl heptanoate is C17H24O3.
When was 4-Allyl-2-methoxyphenyl heptanoate created and modified in PubChem?
4-Allyl-2-methoxyphenyl heptanoate was created on 2007-07-11 and modified on 2023-12-30 in PubChem.
What is the molecular weight of 4-Allyl-2-methoxyphenyl heptanoate?
The molecular weight of 4-Allyl-2-methoxyphenyl heptanoate is 276.4 g/mol.
What is the IUPAC Name of 4-Allyl-2-methoxyphenyl heptanoate?
The IUPAC Name of 4-Allyl-2-methoxyphenyl heptanoate is (2-methoxy-4-prop-2-enylphenyl) heptanoate.
What is the InChIKey of 4-Allyl-2-methoxyphenyl heptanoate?
The InChIKey of 4-Allyl-2-methoxyphenyl heptanoate is SSZHJUHMUSGBLF-UHFFFAOYSA-N.
How many hydrogen bond acceptors does 4-Allyl-2-methoxyphenyl heptanoate have?
4-Allyl-2-methoxyphenyl heptanoate has 3 hydrogen bond acceptors.
What is the topological polar surface area of 4-Allyl-2-methoxyphenyl heptanoate?
The topological polar surface area of 4-Allyl-2-methoxyphenyl heptanoate is 35.5 Ų.
How many rotatable bonds does 4-Allyl-2-methoxyphenyl heptanoate have?
4-Allyl-2-methoxyphenyl heptanoate has 10 rotatable bonds.
Is 4-Allyl-2-methoxyphenyl heptanoate a canonical compound?
Yes, 4-Allyl-2-methoxyphenyl heptanoate is a canonical compound.
What is the XLogP3-AA value of 4-Allyl-2-methoxyphenyl heptanoate?
The XLogP3-AA value of 4-Allyl-2-methoxyphenyl heptanoate is 5.2.
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CAS
93917-78-3 Purity
96%
93917-78-3 Purity
96%
