CAS
94071-14-4 Purity
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94071-14-4 Purity
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![3-[[n'-(2,2,6,6-Tetramethyl-4-piperidyl)ureido]methyl]-1,3,3-trimethylcyclohexyl isocyanate](https://resource.alfa-chemistry.com/structure/94071-19-9.gif)
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4-(Hexyloxy)naphthalene-1-carboxamide
CAS
94071-18-8
Catalog Number
ACM94071188
Category
Other Products
Molecular Weight
271.354140 [g/mol]
Molecular Formula
C17H21NO2
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Specification
Synonyms
EINECS 301-818-3, 4-(Hexyloxy)naphthalene-1-carboxamide, CID3023394, 94071-18-8
IUPAC Name
4-hexoxynaphthalene-1-carboxamide
Canonical SMILES
CCCCCCOC1=CC=C(C2=CC=CC=C21)C(=O)N
InChI Key
QFYXNEUZWKCCEN-UHFFFAOYSA-N
Boiling Point
451.8ºC at 760 mmHg
Flash Point
194.3ºC
Density
1.09g/cm³
EC Number
301-818-3
Exact Mass
271.15700
H-Bond Acceptor
2
H-Bond Donor
1
What is the molecular formula of 4-(Hexyloxy)naphthalene-1-carboxamide?
The molecular formula is C17H21NO2.
What is the molecular weight of 4-(Hexyloxy)naphthalene-1-carboxamide?
The molecular weight is 271.35 g/mol.
What is the IUPAC name of 4-(Hexyloxy)naphthalene-1-carboxamide?
The IUPAC name is 4-hexoxynaphthalene-1-carboxamide.
What is the InChI of 4-(Hexyloxy)naphthalene-1-carboxamide?
The InChI is InChI=1S/C17H21NO2/c1-2-3-4-7-12-20-16-11-10-15(17(18)19)13-8-5-6-9-14(13)16/h5-6,8-11H,2-4,7,12H2,1H3,(H2,18,19).
What is the InChIKey of 4-(Hexyloxy)naphthalene-1-carboxamide?
The InChIKey is QFYXNEUZWKCCEN-UHFFFAOYSA-N.
What is the canonical SMILES of 4-(Hexyloxy)naphthalene-1-carboxamide?
The canonical SMILES is CCCCCCOC1=CC=C(C2=CC=CC=C21)C(=O)N.
How many hydrogen bond donor counts does 4-(Hexyloxy)naphthalene-1-carboxamide have?
It has 1 hydrogen bond donor count.
What is the XLogP3-AA value of 4-(Hexyloxy)naphthalene-1-carboxamide?
The XLogP3-AA value is 4.4.
How many rotatable bond counts does 4-(Hexyloxy)naphthalene-1-carboxamide have?
It has 7 rotatable bond counts.
Is 4-(Hexyloxy)naphthalene-1-carboxamide a covalently-bonded unit?
Yes, it is a covalently-bonded unit.
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CAS
94071-20-2 Purity
96%
94071-20-2 Purity
96%
