Home Carbonyls 5-[bis[(2-methylpropan-2-yl)oxycarbonylamino]methylideneamino]pentanoic acid

5-[bis[(2-methylpropan-2-yl)oxycarbonylamino]methylideneamino]pentanoic acid

CAS No.:
212567-95-8
Catalog Number:
AG01DFRR
Molecular Formula:
C16H29N3O6
Molecular Weight:
359.4180
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Product Description
Catalog Number:
AG01DFRR
Chemical Name:
5-[bis[(2-methylpropan-2-yl)oxycarbonylamino]methylideneamino]pentanoic acid
CAS Number:
212567-95-8
Molecular Formula:
C16H29N3O6
Molecular Weight:
359.4180
MDL Number:
MFCD26940326
IUPAC Name:
5-[bis[(2-methylpropan-2-yl)oxycarbonylamino]methylideneamino]pentanoic acid
InChI:
InChI=1S/C16H29N3O6/c1-15(2,3)24-13(22)18-12(17-10-8-7-9-11(20)21)19-14(23)25-16(4,5)6/h7-10H2,1-6H3,(H,20,21)(H2,17,18,19,22,23)
InChI Key:
PDHAIWOFMLXREX-UHFFFAOYSA-N
SMILES:
O=C(OC(C)(C)C)NC(=NCCCCC(=O)O)NC(=O)OC(C)(C)C
Properties
Complexity:
471  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
359.206g/mol
Formal Charge:
0
Heavy Atom Count:
25  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
359.423g/mol
Monoisotopic Mass:
359.206g/mol
Rotatable Bond Count:
11  
Topological Polar Surface Area:
126A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1  
Properties