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Chemical ID: 4091974
Chemical ID:
4091974
Name [?]:
N'-tert-butylbenzohydrazide
SMILES [?]:
CC(C)(C)NNC(=O)c1ccccc1
InChi [?]:
InChI=1/C11H16N2O/c1-11(2,3)13-12-10(14)9-7-5-4-6-8-9/h4-8,13H,1-3H3,(H,12,14)
InChi Info:
AuxInfo=1/1/N:1,3,4,12,11,13,10,14,9,7,2,6,5,8/E:(1,2,3)(5,6)(7,8)/rA:14nCCCCNNCOCCCCCC/rB:s1;s2;s2;s2;s5;s6;d7;s7;s9;d10;s11;d12;d9s13;/rC:;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C11H16N2O |
All Atoms: | 14 |
Heavy Atoms: | 14 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 7.39459 |
Area: | 380.257 |
Solvation: | -2.11184 |
Coulombic: | -26.1236 |
Bond Count [?]
All: | 14 |
Single: | 10 |
Double: | 4 |
Rotors: | 4 |
Chiral: | 0 |
Rigid Segments: | 4 |
Chemical Properties
Molecular Weight: | 192.258 |
H-Bond Donors: | 2 |
H-Bond Acceptors: | 3 |
XLogP: | 3.1 |
LogP (Chemaxon): | 1.6 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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