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DL-Proline-d7 Hydrochloride

CAT: 0572-TRC-P756052-25MGSize: 25 mgDry Ice: NoHazardous: No
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CAT#:0572-TRC-P756052-25MGSize:25 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
65807-21-8
Synonyms
(RS)-Proline-d7 Hydrochloride; (±)-Proline-d7 Hydrochloride; 2-Pyrrolidinylcarboxylic Acid-d7 Hydrochloride; DL-Pro-d7 Hydrochloride; NSC 97923-d7 Hydrochloride
Hazard Statement
No Data Available
Smiles
[2H]C1(C([2H])(C([2H])(C(C(O)=O)(N1)[2H])[2H])[2H])[2H].Cl
Molecular Formula
C5H2D7NO2 • HCl
Molecular Weight
158.63
InChI
InChI=1S/C5H9NO2.ClH/c7-5(8)4-2-1-3-6-4;/h4,6H,1-3H2,(H,7,8);1H/i1D2,2D2,3D2,4D;
Additionnal Information
IUPAC name: pyrrolidine-2-carboxylic-2,3,3,4,4,5,5-d7 acid hydrochloride
Shipping Conditions
Room Temperature

Chemical Information

1,2,3,3,4,4,5-Heptadeuteriopyrrolidine-2-carboxylic acid;hydrochloride
CAS Number65807-21-8
PubChem CID131698611
IUPAC Name1,2,3,3,4,4,5-heptadeuteriopyrrolidine-2-carboxylic acid;hydrochloride
Molecular FormulaC5H10ClNO2
Molecular Weight158.63
Topological Polar Surface Area49.3
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count3
Rotatable Bond Count1
Heavy Atom Count9
Formal Charge0
Complexity103
SMILES
[2H]C1C(C(C(N1[2H])([2H])C(=O)O)([2H])[2H])([2H])[2H].Cl
InChI
InChI=1S/C5H9NO2.ClH/c7-5(8)4-2-1-3-6-4;/h4,6H,1-3H2,(H,7,8);1H/i1D2,2D2,3D,4D;/hD
InChIKey
UAGFTQCWTTYZKO-GOXZIFBESA-N
Chemical Structure
2D Structure
2D structure of 1,2,3,3,4,4,5-Heptadeuteriopyrrolidine-2-carboxylic acid;hydrochloride
CAS: 65807-21-8
CID: 131698611
Formula: C5H10ClNO2
MW: 158.63
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight158.63
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count3
Rotatable Bond Count1
Exact Mass158.0839435
Monoisotopic Mass158.0839435
Topological Polar Surface Area49.3 Ų
Heavy Atom Count9
Formal Charge0
Complexity103
Isotope Atom Count7
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count2
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

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