Home Aminos (1R,2S)-2-amino-1-(2H-1,3-benzodioxol-5-yl)propan-1-ol

(1R,2S)-2-amino-1-(2H-1,3-benzodioxol-5-yl)propan-1-ol

CAS No.:
188649-92-5
Catalog Number:
AG01BFB9
Molecular Formula:
C10H13NO3
Molecular Weight:
195.2151
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Product Description
Catalog Number:
AG01BFB9
Chemical Name:
(1R,2S)-2-amino-1-(2H-1,3-benzodioxol-5-yl)propan-1-ol
CAS Number:
188649-92-5
Molecular Formula:
C10H13NO3
Molecular Weight:
195.2151
MDL Number:
MFCD20718336
IUPAC Name:
(1R,2S)-2-amino-1-(1,3-benzodioxol-5-yl)propan-1-ol
InChI:
InChI=1S/C10H13NO3/c1-6(11)10(12)7-2-3-8-9(4-7)14-5-13-8/h2-4,6,10,12H,5,11H2,1H3/t6-,10-/m0/s1
InChI Key:
GGNJMBKLSUPVBI-WKEGUHRASA-N
SMILES:
C[C@@H]([C@@H](c1ccc2c(c1)OCO2)O)N
Properties
Complexity:
200  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
2  
Defined Bond Stereocenter Count:
0
Exact Mass:
195.09g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
195.218g/mol
Monoisotopic Mass:
195.09g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
64.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6  
Properties