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138845-32-6 | Methanol, 1-[ethyl[4-[2-(4-nitrophenyl)ethenyl]phenyl]amino]-
CAS No: 138845-32-6 Catalog No: AG0019OB MDL No:
Product Description
Catalog Number:
AG0019OB
Chemical Name:
Methanol, 1-[ethyl[4-[2-(4-nitrophenyl)ethenyl]phenyl]amino]-
CAS Number:
138845-32-6
Molecular Formula:
C17H18N2O3
Molecular Weight:
298.3364
IUPAC Name:
[N-ethyl-4-[2-(4-nitrophenyl)ethenyl]anilino]methanol
InChI:
InChI=1S/C17H18N2O3/c1-2-18(13-20)16-9-5-14(6-10-16)3-4-15-7-11-17(12-8-15)19(21)22/h3-12,20H,2,13H2,1H3
InChI Key:
IAAMBSXYMQDIHX-UHFFFAOYSA-N
SMILES:
CCN(c1ccc(cc1)C=Cc1ccc(cc1)[N+](=O)[O-])CO
Properties
Complexity:
365
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
298.132g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
298.342g/mol
Monoisotopic Mass:
298.132g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
69.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
3.9
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