Chemical ID: 4736670

Cc1ccc(cc1Cl)CN
Chemical ID:
4736670
Name [?]:
(3-chloro-4-methyl-phenyl)methanamine
SMILES [?]:
Cc1ccc(cc1Cl)CN
InChi [?]:
InChI=1/C8H10ClN/c1-6-2-3-7(5-10)4-8(6)9/h2-4H,5,10H2,1H3
InChi Info:
AuxInfo=1/0/N:1,3,4,6,9,2,5,7,8,10/rA:10nCCCCCCCClCN/rB:s1;s2;d3;s4;d5;d2s6;s7;s5;s9;/rC:;;;;;;;;;;

Chemical Details

Atom Count
Formula:C8H10ClN
All Atoms:10
Heavy Atoms:10
Chiral Atoms:0
ZAP Information [?]
Total:6.98309
Area:315.335
Solvation:-0.900273
Coulombic:-13.9929
Bond Count [?]
All:10
Single:7
Double:3
Rotors:1
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:155.624
H-Bond Donors:2
H-Bond Acceptors:1
XLogP:1.99
LogP (Chemaxon):2.15

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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