B(C1=CC(=CC=C1)C(=O)N(C)C)(O)O
CAS: 373384-14-6
الاسم: [3-(dimethylcarbamoyl)phenyl]boronic acid
SMILES: B(C1=CC(=CC=C1)C(=O)N(C)C)(O)O

Molecular Processing

Molecular formula
C9H12BNO3
Molecular weight
193.01
Exact mass
193.091
XLogP
-0.93
TPSA
60.77
H-bond donors
2
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
14
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.222
Molar refractivity
54.29

Supplementary Information

InChIKey: DCXXIDMHTQDSLY-UHFFFAOYSA-N
مرادفات
3-(Dimethylcarbamoyl)benzeneboronic AcidRefChem:495087692-696-3373384-14-6(3-(Dimethylcarbamoyl)phenyl)boronic acid3-(Dimethylcarbamoyl)phenylboronic acid[3-(dimethylcarbamoyl)phenyl]boronic Acid3-(N,N-DIMETHYLAMINOCARBONYL)PHENYLBORONIC ACIDN,N-Dimethylbenzamide-3-boronic acidMFCD03412066BORONIC ACID, [3-[(DIMETHYLAMINO)CARBONYL]PHENYL]-SCHEMBL177412SCHEMBL29902315DTXSID20378430DCXXIDMHTQDSLY-UHFFFAOYSA-N3-dimethylcarbamoylphenylboronic acidSBB071045AKOS006230445AB14351CS-W004904PS-94933-(dimethyl-carbamoyl)phenylboronic acid3-(dimethylcarbamoyl)-phenylboronic acid3-dimethylaminocarbonylphenyl boronic acidBP-10188SY057183DB-010497D4194{3-[(dimethylamino)carbonyl]phenyl}boronic acidEN300-7372407
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