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Uvinul A Plus

CAT: 0572-TRC-U850300-100MGSize: 100 mgDry Ice: NoHazardous: No
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CAT#:0572-TRC-U850300-100MGSize:100 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
302776-68-7
Synonyms
2-[4-(Diethylamino)-2-hydroxybenzoyl]benzoic acid hexyl ester; Hexyl 2-[4-(diethylamino)-2-hydroxybenzoyl]benzoate; Uvinul A Plus; n-Hexyl 2-(4-Diethylamino-2-hydroxybenzoyl)benzoate
Hazard Statement
No Data Available
Purity
>95% (HPLC)
Smiles
CCCCCCOC(=O)c1ccccc1C(=O)c2ccc(cc2O)N(CC)CC
Molecular Formula
C24 H31 N O4
Molecular Weight
397.51
InChI
InChI=1S/C24H31NO4/c1-4-7-8-11-16-29-24(28)20-13-10-9-12-19(20)23(27)21-15-14-18(17-22(21)26)25(5-2)6-3/h9-10,12-15,17,26H,4-8,11,16H2,1-3H3
Additionnal Information
IUPAC name: hexyl 2-[4-(diethylamino)-2-hydroxybenzoyl]benzoate
Shipping Conditions
Room Temperature
Storage Conditions
+4°C

Chemical Information

Hexyl 2-(4-(diethylamino)-2-hydroxybenzoyl)benzoate

Diethylamino hydroxybenzoyl hexyl benzoate is a member of benzophenones.

CAS Number302776-68-7
PubChem CID10111431
IUPAC Namehexyl 2-[4-(diethylamino)-2-hydroxybenzoyl]benzoate
Molecular FormulaC24H31NO4
Molecular Weight397.5
XLogP6.5
Topological Polar Surface Area66.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count12
Heavy Atom Count29
Formal Charge0
Complexity505
SMILES
CCCCCCOC(=O)C1=CC=CC=C1C(=O)C2=C(C=C(C=C2)N(CC)CC)O
InChI
InChI=1S/C24H31NO4/c1-4-7-8-11-16-29-24(28)20-13-10-9-12-19(20)23(27)21-15-14-18(17-22(21)26)25(5-2)6-3/h9-10,12-15,17,26H,4-8,11,16H2,1-3H3
InChIKey
FDATWRLUYRHCJE-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Hexyl 2-(4-(diethylamino)-2-hydroxybenzoyl)benzoate
CAS: 302776-68-7
CID: 10111431
Formula: C24H31NO4
MW: 397.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight397.5
XLogP36.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count12
Exact Mass397.22530847
Monoisotopic Mass397.22530847
Topological Polar Surface Area66.8 Ų
Heavy Atom Count29
Formal Charge0
Complexity505
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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