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129030-32-6 | 3-Furanpropanoic acid, α-amino-, (S)- (9CI)
CAS No: 129030-32-6 Catalog No: AG000YSR MDL No:MFCD09841947
Product Description
Catalog Number:
AG000YSR
Chemical Name:
3-Furanpropanoic acid, α-amino-, (S)- (9CI)
CAS Number:
129030-32-6
Molecular Formula:
C7H9NO3
Molecular Weight:
155.1513
MDL Number:
MFCD09841947
IUPAC Name:
(2S)-2-amino-3-(furan-3-yl)propanoic acid
InChI:
InChI=1S/C7H9NO3/c8-6(7(9)10)3-5-1-2-11-4-5/h1-2,4,6H,3,8H2,(H,9,10)/t6-/m0/s1
InChI Key:
ZAFNLUPTKPOREL-LURJTMIESA-N
SMILES:
OC(=O)[C@H](Cc1cocc1)N
Properties
Complexity:
149
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
155.058g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
155.153g/mol
Monoisotopic Mass:
155.058g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
76.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-2.3
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