Products for Research Use Only
RegisterLogin

3-Hydroxy Benzopyrene-d11

CAT: 0572-TRC-H829402-10MGSize: 10 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0572-TRC-H829402-10MGSize:10 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
CAS Number
1246819-35-1
Hazard Statement
May cause an allergic skin reaction; UN number: UN3077; Packing Group: III
Purity
>95% (HPLC)
Smiles
[2H]c1c([2H])c([2H])c2c(c1[2H])c([2H])c3c([2H])c([2H])c4c(O)c([2H])c([2H])c5c([2H])c([2H])c2c3c45
Molecular Formula
C20HD11O
Molecular Weight
279.38
Shipping Conditions
Room Temperature
Storage Conditions
+4°C

Chemical Information

3-Hydroxy Benzopyrene-d11
CAS Number1246819-35-1
PubChem CID71748900
IUPAC Name1,2,4,5,6,7,8,9,10,11,12-undecadeuteriobenzo[a]pyren-3-ol
Molecular FormulaC20H12O
Molecular Weight279.4
XLogP5.9
Topological Polar Surface Area20.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count0
Heavy Atom Count21
Formal Charge0
Complexity405
SMILES
[2H]C1=C(C(=C2C3=C4C(=C(C2=C1[2H])[2H])C(=C(C5=C(C(=C(C(=C54)C(=C3[2H])[2H])[2H])[2H])O)[2H])[2H])[2H])[2H]
InChI
InChI=1S/C20H12O/c21-18-10-7-12-5-8-16-15-4-2-1-3-13(15)11-14-6-9-17(18)19(12)20(14)16/h1-11,21H/i1D,2D,3D,4D,5D,6D,7D,8D,9D,10D,11D
InChIKey
SPUUWWRWIAEPDB-LFFOKYCESA-N
Chemical Structure
2D Structure
2D structure of 3-Hydroxy Benzopyrene-d11
CAS: 1246819-35-1
CID: 71748900
Formula: C20H12O
MW: 279.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight279.4
XLogP35.9
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count0
Exact Mass279.157859207
Monoisotopic Mass279.157859207
Topological Polar Surface Area20.2 Ų
Heavy Atom Count21
Formal Charge0
Complexity405
Isotope Atom Count11
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Related Products

CatalogName
TRC-H829400-10MG3-Hydroxy Benzopyrene
TRC-H829400-1MG3-Hydroxy Benzopyrene
TRC-H829400-5MG3-Hydroxy Benzopyrene
TRC-H829403-50MG3-Hydroxy Benzopyrene-13C6
TRC-H829410-1MG9-Hydroxy Benzopyrene
TRC-H829410-25MG9-Hydroxy Benzopyrene
TRC-H829410-0.5MG9-Hydroxy Benzopyrene
TRC-H829405-1MG3-Hydroxy Benzopyrene O-Beta-D-glucuronide
TRC-H829405-0.5MG3-Hydroxy Benzopyrene O-b-D-glucuronide
TRC-H829405-10MG3-Hydroxy Benzopyrene O-Beta-D-glucuronide

Alternative Products

CatalogName
HY-144950S3-Hydroxy benzopyrene-d11
AR-B01365-019-Hydroxy Benzopyrene-d11
sc-4904523-Hydroxy Benzopyrene
4258923-Hydroxy Benzopyrene-13C6
AR-B01364-019-Hydroxy Benzopyrene
sc-4904643-Hydroxy Benzopyrene O-β-D-glucuronide
AR-B06805-013-Hydroxy Benzopyrene 3-o-Sulfate Sodium Salt
TMIH-0268-01Hydroxy Tetramethylpyrazine-d11
B83803,4-Benzopyrene
sc-4826513-Methoxy Benzopyrene

Popular Products