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20570-04-1 | 1-Propanamine, 2-chloro-N-methyl-N-(sulfinylamino)-
CAS No: 20570-04-1 Catalog No: AG002AAL MDL No:
Product Description
Catalog Number:
AG002AAL
Chemical Name:
1-Propanamine, 2-chloro-N-methyl-N-(sulfinylamino)-
CAS Number:
20570-04-1
Molecular Formula:
C4H9ClN2OS
Molecular Weight:
168.6451
IUPAC Name:
2-chloro-N-methyl-N-(sulfinylamino)propan-1-amine
InChI:
InChI=1S/C4H9ClN2OS/c1-4(5)3-7(2)6-9-8/h4H,3H2,1-2H3
InChI Key:
IWEWOXQVXPPZAT-UHFFFAOYSA-N
SMILES:
CN(N=S=O)CC(Cl)C
NSC Number:
93112
Properties
Complexity:
126
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
168.012g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
168.639g/mol
Monoisotopic Mass:
168.012g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
33.7A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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