Home Aminos methyl 2-amino-4-(1,3-dioxolan-2-yl)butanoate

methyl 2-amino-4-(1,3-dioxolan-2-yl)butanoate

CAS No.:
2059931-97-2
Catalog Number:
AG01BS5J
Molecular Formula:
C8H15NO4
Molecular Weight:
189.2090
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Product Description
Catalog Number:
AG01BS5J
Chemical Name:
methyl 2-amino-4-(1,3-dioxolan-2-yl)butanoate
CAS Number:
2059931-97-2
Molecular Formula:
C8H15NO4
Molecular Weight:
189.2090
MDL Number:
MFCD30536061
IUPAC Name:
methyl 2-amino-4-(1,3-dioxolan-2-yl)butanoate
InChI:
InChI=1S/C8H15NO4/c1-11-8(10)6(9)2-3-7-12-4-5-13-7/h6-7H,2-5,9H2,1H3
InChI Key:
GXMWIGAIBTXOSG-UHFFFAOYSA-N
SMILES:
COC(=O)C(CCC1OCCO1)N
Properties
Complexity:
168  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
189.1g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
189.211g/mol
Monoisotopic Mass:
189.1g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
70.8A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.4  
Properties