Home Other Building Blocks 2-(5-cyclopropyloxolan-2-yl)acetic acid, Mixture of diastereomers

2-(5-cyclopropyloxolan-2-yl)acetic acid, Mixture of diastereomers

CAS No.:
2138217-61-3
Catalog Number:
AG01EL1J
Molecular Formula:
C9H14O3
Molecular Weight:
170.2057
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Product Description
Catalog Number:
AG01EL1J
Chemical Name:
2-(5-cyclopropyloxolan-2-yl)acetic acid, Mixture of diastereomers
CAS Number:
2138217-61-3
Molecular Formula:
C9H14O3
Molecular Weight:
170.2057
MDL Number:
MFCD31435788
IUPAC Name:
2-(5-cyclopropyloxolan-2-yl)acetic acid
InChI:
InChI=1S/C9H14O3/c10-9(11)5-7-3-4-8(12-7)6-1-2-6/h6-8H,1-5H2,(H,10,11)
InChI Key:
QKINABTWHHGBCW-UHFFFAOYSA-N
SMILES:
OC(=O)CC1CCC(O1)C1CC1
Properties
Complexity:
186  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
170.094g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
170.208g/mol
Monoisotopic Mass:
170.094g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9  
Properties