CC1=C(C=C(C=C1)O)N
CAS: 2836-00-2
Name: 3-amino-4-methylphenol
SMILES: CC1=C(C=C(C=C1)O)N

Molecular Processing

Molecular formula
C7H9NO
Molecular weight
123.15
Exact mass
123.0684
XLogP
1.28
TPSA
46.25
H-bond donors
2
H-bond acceptors
2
Rotatable bonds
0
Heavy atoms
9
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.143
Molar refractivity
37.26

Supplementary Information

InChIKey: NUNAWQZKZVVELQ-UHFFFAOYSA-N
Synonyme
3-AMINO-4-METHYLPHENOL2836-00-22-Amino-4-hydroxytoluenePhenol, 3-amino-4-methyl-3-Amino-p-cresolp-Cresol, 3-amino-EINECS 220-622-8DTXSID30748603A4MP5Hydroxyotoluidine3Amino4methylphenol2Amino4hydroxytoluenePhenol, 3amino4methylRefChem:4976865-HYDROXY-O-TOLUIDINEDTXCID0037811220-622-8MFCD000750833-Amino-4-methyl-phenol5-hydroxy-2-methylaniline3-Amino-p-kresolSCHEMBL63944SCHEMBL4141575SCHEMBL23293746SCHEMBL27606269SCHEMBL28321578SBB069794AKOS006228569AC-3749CS-W005693
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