Home Other Building Blocks 4-AMINOPHENYL-ALPHA-D-GLUCOPYRANOSIDE

4-AMINOPHENYL-ALPHA-D-GLUCOPYRANOSIDE

CAS No.:
31302-52-0
Catalog Number:
AG00C0PO
Molecular Formula:
C12H17NO6
Molecular Weight:
271.2665
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Product Description
Catalog Number:
AG00C0PO
Chemical Name:
4-AMINOPHENYL-ALPHA-D-GLUCOPYRANOSIDE
CAS Number:
31302-52-0
Molecular Formula:
C12H17NO6
Molecular Weight:
271.2665
MDL Number:
MFCD00067364
IUPAC Name:
(2R,3R,4S,5S,6R)-2-(4-aminophenoxy)-6-(hydroxymethyl)oxane-3,4,5-triol
InChI:
InChI=1S/C12H17NO6/c13-6-1-3-7(4-2-6)18-12-11(17)10(16)9(15)8(5-14)19-12/h1-4,8-12,14-17H,5,13H2/t8-,9-,10+,11-,12+/m1/s1
InChI Key:
MIAKOEWBCMPCQR-ZIQFBCGOSA-N
SMILES:
OCC1O[C@H](Oc2ccc(cc2)N)C([C@@H]([C@@H]1O)O)O C12H17NO6
Properties
Complexity:
283  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
5  
Defined Bond Stereocenter Count:
0
Exact Mass:
271.106g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
5  
Isotope Atom Count:
0
Molecular Weight:
271.269g/mol
Monoisotopic Mass:
271.106g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
125A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1  
Properties