Home Other Building Blocks 2-[(2-methylfuran-3-yl)formamido]acetic acid

2-[(2-methylfuran-3-yl)formamido]acetic acid

CAS No.:
926226-44-0
Catalog Number:
AG019VKH
Molecular Formula:
C8H9NO4
Molecular Weight:
183.1614
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Product Description
Catalog Number:
AG019VKH
Chemical Name:
2-[(2-methylfuran-3-yl)formamido]acetic acid
CAS Number:
926226-44-0
Molecular Formula:
C8H9NO4
Molecular Weight:
183.1614
MDL Number:
MFCD09049417
IUPAC Name:
2-[(2-methylfuran-3-carbonyl)amino]acetic acid
InChI:
InChI=1S/C8H9NO4/c1-5-6(2-3-13-5)8(12)9-4-7(10)11/h2-3H,4H2,1H3,(H,9,12)(H,10,11)
InChI Key:
PLBRTLVOUUQEQA-UHFFFAOYSA-N
SMILES:
Cc1occc1C(=O)NCC(=O)O
Properties
Complexity:
216  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
183.053g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
183.163g/mol
Monoisotopic Mass:
183.053g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
79.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3  
Properties