Chemical ID: 4117497

c1cc(cc(c1)Cl)CCN
Chemical ID:
4117497
Name [?]:
2-(3-chlorophenyl)ethanamine
SMILES [?]:
c1cc(cc(c1)Cl)CCN
InChi [?]:
InChI=1/C8H10ClN/c9-8-3-1-2-7(6-8)4-5-10/h1-3,6H,4-5,10H2
InChi Info:
AuxInfo=1/0/N:1,2,6,8,9,4,3,5,7,10/rA:10nCCCCCCClCCN/rB:s1;d2;s3;d4;d1s5;s5;s3;s8;s9;/rC:;;;;;;;;;;

Chemical Details

Atom Count
Formula:C8H10ClN
All Atoms:10
Heavy Atoms:10
Chiral Atoms:0
ZAP Information [?]
Total:7.31424
Area:325.785
Solvation:-0.830385
Coulombic:-14.4137
Bond Count [?]
All:10
Single:7
Double:3
Rotors:2
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:155.624
H-Bond Donors:2
H-Bond Acceptors:1
XLogP:1.92
LogP (Chemaxon):1.93

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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