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18946-99-1 | Thallium, (dipropylcarbamodithioato-S,S')- (9CI)
CAS No: 18946-99-1 Catalog No: AG002DPO MDL No:
Product Description
Catalog Number:
AG002DPO
Chemical Name:
Thallium, (dipropylcarbamodithioato-S,S')- (9CI)
CAS Number:
18946-99-1
IUPAC Name:
3-hexylpentanedioic acid
InChI:
InChI=1S/C11H20O4/c1-2-3-4-5-6-9(7-10(12)13)8-11(14)15/h9H,2-8H2,1H3,(H,12,13)(H,14,15)
InChI Key:
CGYIPJNNRRYASC-UHFFFAOYSA-N
Properties
Complexity:
185
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
216.136g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
216.277g/mol
Monoisotopic Mass:
216.136g/mol
Rotatable Bond Count:
9
Topological Polar Surface Area:
74.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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