CAS: 3814-18-4
الاسم: 3-nitrobenzenethiol
SMILES:
C1=CC(=CC(=C1)S)[N+](=O)[O-]Molecular Processing
Molecular formula
C6H5NO2S
Molecular weight
155.18
Exact mass
155.0041
XLogP
1.88
TPSA
43.14
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
1
Heavy atoms
10
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0
Molar refractivity
40.35
Supplementary Information
InChIKey: HBCSOCHVMJKLLO-UHFFFAOYSA-N
مرادفات
3-nitrobenzene-1-thiolRefChem:504481829-772-43-nitrobenzenethiol3814-18-43-NITRO-BENZENETHIOLBenzenethiol, 3-nitro-MFCD184518443-nitrothiophenolm-Nitrobenzenethiolmeta-nitrothiophenolNSC536433-nitrophenylmercaptanSCHEMBL487496SCHEMBL544417SCHEMBL16005234DTXSID60287951HBCSOCHVMJKLLO-UHFFFAOYSA-NNSC-53643SBB079030AKOS005142976AT20860AS-82797SY043185EN300-172196
مشارك في 9 تفاعل→