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Chemical ID: 5184356
Chemical ID:
5184356
Name [?]:
N,N-dipropylpropane-1-sulfonamide
SMILES [?]:
CCCN(CCC)S(=O)(=O)CCC
InChi [?]:
InChI=1/C9H21NO2S/c1-4-7-10(8-5-2)13(11,12)9-6-3/h4-9H2,1-3H3
InChi Info:
AuxInfo=1/0/N:1,7,13,2,6,12,3,5,11,4,9,10,8/E:(1,2)(4,5)(7,8)(11,12)/CRV:13.6/rA:13nCCCNCCCSOOCCC/rB:s1;s2;s3;s4;s5;s6;s4;d8;d8;s8;s11;s12;/rC:;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C9H21NO2S |
All Atoms: | 13 |
Heavy Atoms: | 13 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 8.01318 |
Area: | 401.376 |
Solvation: | -2.02121 |
Coulombic: | -6.35492 |
Bond Count [?]
All: | 12 |
Single: | 10 |
Double: | 2 |
Rotors: | 7 |
Chiral: | 0 |
Rigid Segments: | 5 |
Chemical Properties
Molecular Weight: | 207.335 |
H-Bond Donors: | 0 |
H-Bond Acceptors: | 3 |
XLogP: | 1.94 |
LogP (Chemaxon): | 1.68 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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