Home Other Building Blocks 2-hydroxy-2-(oxolan-3-yl)propanoic acid

2-hydroxy-2-(oxolan-3-yl)propanoic acid

CAS No.:
1537043-47-2
Catalog Number:
AG01BCBX
Molecular Formula:
C7H12O4
Molecular Weight:
160.1678
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Product Description
Catalog Number:
AG01BCBX
Chemical Name:
2-hydroxy-2-(oxolan-3-yl)propanoic acid
CAS Number:
1537043-47-2
Molecular Formula:
C7H12O4
Molecular Weight:
160.1678
MDL Number:
MFCD21844586
IUPAC Name:
2-hydroxy-2-(oxolan-3-yl)propanoic acid
InChI:
InChI=1S/C7H12O4/c1-7(10,6(8)9)5-2-3-11-4-5/h5,10H,2-4H2,1H3,(H,8,9)
InChI Key:
GZKKBIVLRCOXRB-UHFFFAOYSA-N
SMILES:
OC(=O)C(C1COCC1)(O)C
Properties
Complexity:
168  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
160.074g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
160.169g/mol
Monoisotopic Mass:
160.074g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
66.8A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.4  
Properties