Chemical ID: 6659818

CC(C)Nc1ccccc1
Chemical ID:
6659818
Name [?]:
N-isopropylaniline
SMILES [?]:
CC(C)Nc1ccccc1
InChi [?]:
InChI=1/C9H13N/c1-8(2)10-9-6-4-3-5-7-9/h3-8,10H,1-2H3
InChi Info:
AuxInfo=1/0/N:1,3,8,7,9,6,10,2,5,4/E:(1,2)(4,5)(6,7)/rA:10nCCCNCCCCCC/rB:s1;s2;s2;s4;s5;d6;s7;d8;d5s9;/rC:;;;;;;;;;;

Chemical Details

Atom Count
Formula:C9H13N
All Atoms:10
Heavy Atoms:10
Chiral Atoms:0
ZAP Information [?]
Total:6.83118
Area:305.99
Solvation:-0.818562
Coulombic:-13.3231
Bond Count [?]
All:10
Single:7
Double:3
Rotors:2
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:135.206
H-Bond Donors:1
H-Bond Acceptors:1
XLogP:2.55
LogP (Chemaxon):2.38

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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