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2-Methylnaphthalene-D10

CAT: 0572-TRC-M323133-250MGSize: 250 mgDry Ice: NoHazardous: No
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CAT#:0572-TRC-M323133-250MGSize:250 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
7297-45-2
Synonyms
Naphthalene-1,2,3,4,5,6,8-d7, 7-(methyl-d3)-;7-(Methyl-d3)naphthalene-1,2,3,4,5,6,8-d7; β-Methylnaphthalene-d10; 2-Methylnaphthalene D10
Hazard Statement
Harmful if swallowed; UN number: UN3077; Packing Group: III
Purity
>95% (HPLC)
Smiles
[2H]c1c([2H])c([2H])c2c([2H])c(c([2H])c([2H])c2c1[2H])C([2H])([2H])[2H]
Molecular Formula
C11 2H10
Molecular Weight
152.26
InChI
InChI=1S/C11H10/c1-9-6-7-10-4-2-3-5-11(10)8-9/h2-8H,1H3/i1D3,2D,3D,4D,5D,6D,7D,8D
Additionnal Information
IUPAC name: 1,2,3,4,5,6,8-heptadeuterio-7-(trideuteriomethyl)naphthalene
Shipping Conditions
Room Temperature
Storage Conditions
+4°C

Chemical Information

2-Methylnaphthalene-d10
CAS Number7297-45-2
PubChem CID11062578
IUPAC Name1,2,3,4,5,6,8-heptadeuterio-7-(trideuteriomethyl)naphthalene
Molecular FormulaC11H10
Molecular Weight152.26
XLogP3.9
Topological Polar Surface Area0
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count0
Rotatable Bond Count0
Heavy Atom Count11
Formal Charge0
Complexity128
SMILES
[2H]C1=C(C(=C2C(=C(C(=C(C2=C1[2H])[2H])[2H])C([2H])([2H])[2H])[2H])[2H])[2H]
InChI
InChI=1S/C11H10/c1-9-6-7-10-4-2-3-5-11(10)8-9/h2-8H,1H3/i1D3,2D,3D,4D,5D,6D,7D,8D
InChIKey
QIMMUPPBPVKWKM-UZHHFJDZSA-N
Chemical Structure
2D Structure
2D structure of 2-Methylnaphthalene-d10
CAS: 7297-45-2
CID: 11062578
Formula: C11H10
MW: 152.26
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight152.26
XLogP33.9
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count0
Rotatable Bond Count0
Exact Mass152.141017778
Monoisotopic Mass152.141017778
Topological Polar Surface Area0 Ų
Heavy Atom Count11
Formal Charge0
Complexity128
Isotope Atom Count10
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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