Chemical ID: 4735504

CC(C)(C)c1ccc(cc1)N(C)C
Chemical ID:
4735504
Name [?]:
N,N-dimethyl-4-tert-butyl-aniline
SMILES [?]:
CC(C)(C)c1ccc(cc1)N(C)C
InChi [?]:
InChI=1/C12H19N/c1-12(2,3)10-6-8-11(9-7-10)13(4)5/h6-9H,1-5H3
InChi Info:
AuxInfo=1/0/N:1,3,4,12,13,6,10,7,9,5,8,2,11/E:(1,2,3)(4,5)(6,7)(8,9)/rA:13nCCCCCCCCCCNCC/rB:s1;s2;s2;s2;s5;d6;s7;d8;d5s9;s8;s11;s11;/rC:;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C12H19N
All Atoms:13
Heavy Atoms:13
Chiral Atoms:0
ZAP Information [?]
Total:8.00326
Area:361.943
Solvation:-1.04532
Coulombic:-8.27315
Bond Count [?]
All:13
Single:10
Double:3
Rotors:2
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:177.286
H-Bond Donors:0
H-Bond Acceptors:1
XLogP:4.05
LogP (Chemaxon):3.94

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Descriptor Annotations

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