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1-Naphthol-d7

CAT: 0804-HY-Y1309S1-01Size: 1 mgDry Ice: NoHazardous: No
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CAT#:0804-HY-Y1309S1-01Size:1 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
1-Naphthol-d7 is the deuterium labeled Naphthol[1].
CAS Number
124251-84-9
Product Name Alternative
Furro ER-d7; NSC 9586-d7; Nako TRB-d7
UNSPSC
12352005
Hazard Statement
H302+H312, H315, H318, H335
Target
Isotope-Labeled Compounds
Type
Isotope-Labeled Compounds
Related Pathways
Others
Field of Research
Others
Purity
99.44
Solubility
DMSO : 100 mg/mL (ultrasonic)
Smiles
OC1=C([2H])C([2H])=C([2H])C2=C1C([2H])=C([2H])C([2H])=C2[2H]
Molecular Formula
C10HD7O
Molecular Weight
151.21
Precautions
H302+H312, H315, H318, H335
References & Citations
[1]Russak EM, et al. Impact of Deuterium Substitution on the Pharmacokinetics of Pharmaceuticals. Ann Pharmacother. 2019 Feb;53 (2) :211-216.
Shipping Conditions
Room Temperature
Storage Conditions
4°C (Powder, stored under nitrogen)
Scientific Category
Isotope-Labeled Compounds
Clinical Information
No Development Reported

Chemical Information

(~2~H_7_)Naphthalen-1-ol
CAS Number124251-84-9
PubChem CID16213355
IUPAC Name2,3,4,5,6,7,8-heptadeuterionaphthalen-1-ol
Molecular FormulaC10H8O
Molecular Weight151.21
XLogP2.8
Topological Polar Surface Area20.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count0
Heavy Atom Count11
Formal Charge0
Complexity133
SMILES
[2H]C1=C(C(=C2C(=C1[2H])C(=C(C(=C2O)[2H])[2H])[2H])[2H])[2H]
InChI
InChI=1S/C10H8O/c11-10-7-3-5-8-4-1-2-6-9(8)10/h1-7,11H/i1D,2D,3D,4D,5D,6D,7D
InChIKey
KJCVRFUGPWSIIH-GSNKEKJESA-N
Chemical Structure
2D Structure
2D structure of (~2~H_7_)Naphthalen-1-ol
CAS: 124251-84-9
CID: 16213355
Formula: C10H8O
MW: 151.21
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight151.21
XLogP32.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count0
Exact Mass151.101452096
Monoisotopic Mass151.101452096
Topological Polar Surface Area20.2 Ų
Heavy Atom Count11
Formal Charge0
Complexity133
Isotope Atom Count7
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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