200,000+ products from a single source!
sales@angenechem.com
Home > Nitro Compounds > 792947-05-8
792947-05-8 | (E)-3-[5-(4-methyl-2-nitrophenyl)-2-furyl]-2-propenoic acid
CAS No: 792947-05-8 Catalog No: AG00JD8Y MDL No:MFCD06666162
Product Description
Catalog Number:
AG00JD8Y
Chemical Name:
(E)-3-[5-(4-methyl-2-nitrophenyl)-2-furyl]-2-propenoic acid
CAS Number:
792947-05-8
Molecular Formula:
C14H11NO5
Molecular Weight:
273.2408
MDL Number:
MFCD06666162
IUPAC Name:
3-[5-(4-methyl-2-nitrophenyl)furan-2-yl]prop-2-enoic acid
InChI:
InChI=1S/C14H11NO5/c1-9-2-5-11(12(8-9)15(18)19)13-6-3-10(20-13)4-7-14(16)17/h2-8H,1H3,(H,16,17)
InChI Key:
PHEPHHWAAYYNEQ-UHFFFAOYSA-N
SMILES:
OC(=O)/C=C/c1ccc(o1)c1ccc(cc1[N+](=O)[O-])C
Properties
Complexity:
403
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
273.064g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
273.244g/mol
Monoisotopic Mass:
273.064g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
96.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
2.8
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.