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78961-20-3 | Dodecylamine, chloroacetate
CAS No: 78961-20-3 Catalog No: AG005CU0 MDL No:
Product Description
Catalog Number:
AG005CU0
Chemical Name:
Dodecylamine, chloroacetate
CAS Number:
78961-20-3
Molecular Formula:
C14H30ClNO2
Molecular Weight:
279.8465
IUPAC Name:
2-chloroacetic acid;dodecan-1-amine
InChI:
InChI=1S/C12H27N.C2H3ClO2/c1-2-3-4-5-6-7-8-9-10-11-12-13;3-1-2(4)5/h2-13H2,1H3;1H2,(H,4,5)
InChI Key:
LCZIQCSYIXULBD-UHFFFAOYSA-N
SMILES:
ClCC(=O)O.CCCCCCCCCCCCN
Properties
Complexity:
124
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
279.197g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
279.849g/mol
Monoisotopic Mass:
279.197g/mol
Rotatable Bond Count:
11
Topological Polar Surface Area:
63.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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