Home Other Building Blocks 2-(DIETHYLAMINO)BUTANOIC ACID

2-(DIETHYLAMINO)BUTANOIC ACID

CAS No.:
855152-24-8
Catalog Number:
AG01DKQ4
Molecular Formula:
C8H17NO2
Molecular Weight:
159.2261
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Product Description
Catalog Number:
AG01DKQ4
Chemical Name:
2-(DIETHYLAMINO)BUTANOIC ACID
CAS Number:
855152-24-8
Molecular Formula:
C8H17NO2
Molecular Weight:
159.2261
MDL Number:
MFCD12065023
IUPAC Name:
2-(diethylamino)butanoic acid
InChI:
InChI=1S/C8H17NO2/c1-4-7(8(10)11)9(5-2)6-3/h7H,4-6H2,1-3H3,(H,10,11)
InChI Key:
WXZZJKVGEJBSJP-UHFFFAOYSA-N
SMILES:
CCN(C(C(=O)O)CC)CC
Properties
Complexity:
121  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
159.126g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
159.229g/mol
Monoisotopic Mass:
159.126g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.8  
Properties