CAS: 18102-21-1
名称: 2,3,6-trimethylaniline
SMILES:
CC1=C(C(=C(C=C1)C)N)CMolecular Processing
Molecular formula
C9H13N
Molecular weight
135.21
Exact mass
135.1048
XLogP
2.19
TPSA
26.02
H-bond donors
1
H-bond acceptors
1
Rotatable bonds
0
Heavy atoms
10
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
1
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
45.07
Supplementary Information
InChIKey: FHMPFSKGDPKPDJ-UHFFFAOYSA-N
同義語
2,3,6-Trimethylaniline18102-21-1DTXSID30474750RefChem:244295DTXCID70425564Benzenamine, 2,3,6-trimethyl-MFCD099659292.3.6-Trimethylanilin2,3,6-trimethylphenylamine2,3,6-trimethyl-benzenamineSCHEMBL394750SCHEMBL8830102SCHEMBL16684598SCHEMBL16684610FHMPFSKGDPKPDJ-UHFFFAOYSA-NSBB085908AKOS006342842BS-45545DB-239451CS-0159889F695279
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