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139729-44-5 | Acetic acid, 2-[2-[[3-[4-(3-aminopropoxy)butoxy]propyl]amino]-2-oxoethoxy]-
CAS No: 139729-44-5 Catalog No: AG001BMG MDL No:
Product Description
Catalog Number:
AG001BMG
Chemical Name:
Acetic acid, 2-[2-[[3-[4-(3-aminopropoxy)butoxy]propyl]amino]-2-oxoethoxy]-
CAS Number:
139729-44-5
Molecular Formula:
C14H28N2O6
Molecular Weight:
320.3819
IUPAC Name:
2-[2-[3-[4-(3-aminopropoxy)butoxy]propylamino]-2-oxoethoxy]acetic acid
InChI:
InChI=1S/C14H28N2O6/c15-5-3-9-20-7-1-2-8-21-10-4-6-16-13(17)11-22-12-14(18)19/h1-12,15H2,(H,16,17)(H,18,19)
InChI Key:
SSZZRQPBMUWFQR-UHFFFAOYSA-N
SMILES:
NCCCOCCCCOCCCNC(=O)COCC(=O)O
Properties
Complexity:
289
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
320.195g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
320.386g/mol
Monoisotopic Mass:
320.195g/mol
Rotatable Bond Count:
16
Topological Polar Surface Area:
120A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-3.1
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