Home Aminos 2-(4-aminooxan-3-yl)acetic acid, Mixture of diastereomers

2-(4-aminooxan-3-yl)acetic acid, Mixture of diastereomers

CAS No.:
1782510-80-8
Catalog Number:
AG01ELK7
Molecular Formula:
C7H13NO3
Molecular Weight:
159.1830
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Product Description
Catalog Number:
AG01ELK7
Chemical Name:
2-(4-aminooxan-3-yl)acetic acid, Mixture of diastereomers
CAS Number:
1782510-80-8
Molecular Formula:
C7H13NO3
Molecular Weight:
159.1830
MDL Number:
MFCD31559713
IUPAC Name:
2-(4-aminooxan-3-yl)acetic acid
InChI:
InChI=1S/C7H13NO3/c8-6-1-2-11-4-5(6)3-7(9)10/h5-6H,1-4,8H2,(H,9,10)
InChI Key:
OFIIHBDCVJEGKC-UHFFFAOYSA-N
SMILES:
NC1CCOCC1CC(=O)O
Properties
Complexity:
149  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
159.09g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
159.185g/mol
Monoisotopic Mass:
159.09g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
72.6A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
-3.2  
Properties