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2,3,6-trimethylaniline

2,3,6-trimethylaniline

CAS: 18102-21-1

Formula: C9H13N

SMILES: CC1=CC=C(C)C(N)=C1C

IUPAC: 2,3,6-trimethylaniline

InChI: InChI=1S/C9H13N/c1-6-4-5-7(2)9(10)8(6)3/h4-5H,10H2,1-3H3

Composition: C (79.95%), H (9.69%), N (10.36%)

Molar Mass: 135.21

Atom Count: 23

Heavy Atom Count: 10

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 135.104799423
Formal Charge 0
FSP3 0.33
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 1
InChIKey FHMPFSKGDPKPDJ-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 45.88
Topological Polar Surface Area 26.02
Polarizability 16.79
Ring Count 1
Rotatable Bond Count 0

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