Chemical ID: 6685847

CNc1ccccc1N
Chemical ID:
6685847
Name [?]:
N-methylbenzene-1,2-diamine
SMILES [?]:
CNc1ccccc1N
InChi [?]:
InChI=1/C7H10N2/c1-9-7-5-3-2-4-6(7)8/h2-5,9H,8H2,1H3
InChi Info:
AuxInfo=1/0/N:1,6,5,7,4,8,3,9,2/rA:9nCNCCCCCCN/rB:s1;s2;s3;d4;s5;d6;d3s7;s8;/rC:;;;;;;;;;

Chemical Details

Atom Count
Formula:C7H10N2
All Atoms:9
Heavy Atoms:9
Chiral Atoms:0
ZAP Information [?]
Total:5.78352
Area:278.971
Solvation:-1.19075
Coulombic:-29.017
Bond Count [?]
All:9
Single:6
Double:3
Rotors:1
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:122.168
H-Bond Donors:3
H-Bond Acceptors:2
XLogP:0.85
LogP (Chemaxon):0.84

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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