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3032-58-4

3032-58-4 | Sulfuric acid, monododecyl ester, compd. with 2-propanamine (1:1)

CAS No: 3032-58-4 Catalog No: AG002ZRE MDL No:

Product Description

Catalog Number:
AG002ZRE
Chemical Name:
Sulfuric acid, monododecyl ester, compd. with 2-propanamine (1:1)
CAS Number:
3032-58-4
Molecular Formula:
C15H35NO4S
Molecular Weight:
325.5077
IUPAC Name:
dodecyl hydrogen sulfate;propan-2-amine
InChI:
InChI=1S/C12H26O4S.C3H9N/c1-2-3-4-5-6-7-8-9-10-11-12-16-17(13,14)15;1-3(2)4/h2-12H2,1H3,(H,13,14,15);3H,4H2,1-2H3
InChI Key:
MDZWIXZQWCUXAB-UHFFFAOYSA-N
SMILES:
CC(N)C.CCCCCCCCCCCCOS(=O)(=O)O

Properties

Complexity:
255  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
325.229g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
325.508g/mol
Monoisotopic Mass:
325.229g/mol
Rotatable Bond Count:
12  
Topological Polar Surface Area:
98A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

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