Home Aminos 1,2-Benzenediol, 4-(2-aminoethyl-1,1,2,2-d4)-, hydrochloride (1:1)

1,2-Benzenediol, 4-(2-aminoethyl-1,1,2,2-d4)-, hydrochloride (1:1)

CAS No.:
203633-19-6
Catalog Number:
AG00291C
Molecular Formula:
C8H8ClD4NO2
Molecular Weight:
193.6640
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Product Description
Catalog Number:
AG00291C
Chemical Name:
1,2-Benzenediol, 4-(2-aminoethyl-1,1,2,2-d4)-, hydrochloride (1:1)
CAS Number:
203633-19-6
Molecular Formula:
C8H8ClD4NO2
Molecular Weight:
193.6640
MDL Number:
MFCD01317352
IUPAC Name:
4-(2-amino-1,1,2,2-tetradeuterioethyl)benzene-1,2-diol;hydrochloride
InChI:
InChI=1S/C8H11NO2.ClH/c9-4-3-6-1-2-7(10)8(11)5-6;/h1-2,5,10-11H,3-4,9H2;1H/i3D2,4D2;
InChI Key:
CTENFNNZBMHDDG-URZLSVTISA-N
SMILES:
Oc1ccc(cc1O)C(C(N)([2H])[2H])([2H])[2H].Cl
Properties
Complexity:
119  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
193.081g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
4  
Isotope Atom Count:
4  
Molecular Weight:
193.663g/mol
Monoisotopic Mass:
193.081g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
66.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties