CAS
99282-79-8 Purity
96%
99282-79-8 Purity
96%
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Salor-int l497525-1ea
CAS
99283-84-8
Catalog Number
ACM99283848
Category
Other Products
Molecular Weight
307.4278
Molecular Formula
C18H29NO3
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Specification
Synonyms
Ethanone, 1-[4-(decyloxy)-2-hydroxyphenyl]-, oxime, 99283-84-8, ACMC-20m2qk, AC1OA85X, CTK3G7553, 3-decoxy-6-[1-(hydroxyamino)ethylidene]cyclohexa-2,4-dien-1-one
IUPAC Name
3-decoxy-6-[1-(hydroxyamino)ethylidene]cyclohexa-2,4-dien-1-one
Canonical SMILES
CCCCCCCCCCOC1=CC(=O)C(=C(C)NO)C=C1
InChI Key
MELUUVAWVGKGKK-UHFFFAOYSA-N
Exact Mass
307.21500
H-Bond Acceptor
4
H-Bond Donor
2
What is the molecular formula of the compound in the reference?
The molecular formula is C18H29NO3.
What is the molecular weight of the compound?
The molecular weight is 307.4 g/mol.
What is the IUPAC Name of the compound?
The IUPAC Name is 5-decoxy-2-[(E)-N-hydroxy-C-methylcarbonimidoyl]phenol.
What is the InChIKey of the compound?
The InChIKey is OHIORSVUWCEHNT-XDJHFCHBSA-N.
How many hydrogen bond donor counts does the compound have?
It has 2 hydrogen bond donor counts.
What is the XLogP3-AA value of the compound?
The XLogP3-AA value is 6.
How many rotatable bond counts does the compound have?
It has 11 rotatable bond counts.
What is the Topological Polar Surface Area of the compound?
The Topological Polar Surface Area is 62?2.
Does the compound have any defined bond stereocenter counts?
It has 1 defined bond stereocenter count.
Is the compound canonicalized?
Yes, the compound is canonicalized.
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