Home Other Building Blocks [2-(DIMETHYLAMINO)-5-NITROPHENYL]METHANOL

[2-(DIMETHYLAMINO)-5-NITROPHENYL]METHANOL

CAS No.:
544693-91-6
Catalog Number:
AG01EMI9
Molecular Formula:
C9H12N2O3
Molecular Weight:
196.2032
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Product Description
Catalog Number:
AG01EMI9
Chemical Name:
[2-(DIMETHYLAMINO)-5-NITROPHENYL]METHANOL
CAS Number:
544693-91-6
Molecular Formula:
C9H12N2O3
Molecular Weight:
196.2032
MDL Number:
MFCD11191403
IUPAC Name:
[2-(dimethylamino)-5-nitrophenyl]methanol
InChI:
InChI=1S/C9H12N2O3/c1-10(2)9-4-3-8(11(13)14)5-7(9)6-12/h3-5,12H,6H2,1-2H3
InChI Key:
OPCYVWYGJNKLES-UHFFFAOYSA-N
SMILES:
OCc1cc(ccc1N(C)C)[N+](=O)[O-]
Properties
Complexity:
203  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
196.085g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
196.206g/mol
Monoisotopic Mass:
196.085g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
69.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1  
Properties