Home Other Building Blocks 2-(octylcarbamoyl)acetic acid

2-(octylcarbamoyl)acetic acid

CAS No.:
3151-49-3
Catalog Number:
AG01B27A
Molecular Formula:
C11H21NO3
Molecular Weight:
215.2893
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Product Description
Catalog Number:
AG01B27A
Chemical Name:
2-(octylcarbamoyl)acetic acid
CAS Number:
3151-49-3
Molecular Formula:
C11H21NO3
Molecular Weight:
215.2893
MDL Number:
MFCD24229935
IUPAC Name:
3-(octylamino)-3-oxopropanoic acid
InChI:
InChI=1S/C11H21NO3/c1-2-3-4-5-6-7-8-12-10(13)9-11(14)15/h2-9H2,1H3,(H,12,13)(H,14,15)
InChI Key:
HBVNXRIQVTWNJQ-UHFFFAOYSA-N
SMILES:
CCCCCCCCNC(=O)CC(=O)O
Properties
Complexity:
192  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
215.152g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
215.293g/mol
Monoisotopic Mass:
215.152g/mol
Rotatable Bond Count:
9  
Topological Polar Surface Area:
66.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7  
Properties