Chemical ID: 4670079

CCCCC(C)n1c2ccccc2c3c1cccc3
Chemical ID:
4670079
Name [?]:
9-(1-methylpentyl)carbazole
SMILES [?]:
CCCCC(C)n1c2ccccc2c3c1cccc3
InChi [?]:
InChI=1/C18H21N/c1-3-4-9-14(2)19-17-12-7-5-10-15(17)16-11-6-8-13-18(16)19/h5-8,10-14H,3-4,9H2,1-2H3
InChi Info:
AuxInfo=1/0/N:1,6,2,3,11,18,10,17,4,12,19,9,16,5,13,14,8,15,7/E:(5,6)(7,8)(10,11)(12,13)(15,16)(17,18)/rA:19cCCCCCCNCCCCCCCCCCCC/rB:s1;s2;s3;s4;s5;s5;s7;s8;d9;s10;d11;d8s12;s13;s7s14;d15;s16;d17;d14s18;/rC:;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C18H21N
All Atoms:19
Heavy Atoms:19
Chiral Atoms:1
ZAP Information [?]
Total:10.3088
Area:457.948
Solvation:-1.13991
Coulombic:-9.7579
Bond Count [?]
All:21
Single:15
Double:6
Rotors:4
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:251.366
H-Bond Donors:0
H-Bond Acceptors:0
XLogP:6.21
LogP (Chemaxon):6.11

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Descriptor Annotations

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