200,000+ products from a single source!
sales@angenechem.com
Home > Nitro Compounds > 13795-24-9
13795-24-9 | Carbonic acid, 4-nitrophenyl phenylmethyl ester
CAS No: 13795-24-9 Catalog No: AG0017Q3 MDL No:MFCD00007323
Product Description
Catalog Number:
AG0017Q3
Chemical Name:
Carbonic acid, 4-nitrophenyl phenylmethyl ester
CAS Number:
13795-24-9
Molecular Formula:
C14H11NO5
Molecular Weight:
273.2408
MDL Number:
MFCD00007323
IUPAC Name:
benzyl (4-nitrophenyl) carbonate
InChI:
InChI=1S/C14H11NO5/c16-14(19-10-11-4-2-1-3-5-11)20-13-8-6-12(7-9-13)15(17)18/h1-9H,10H2
InChI Key:
QIXRWIVDBZJDGD-UHFFFAOYSA-N
SMILES:
O=C(Oc1ccc(cc1)[N+](=O)[O-])OCc1ccccc1
NSC Number:
171047
Properties
Complexity:
327
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:
0
Isotope Atom Count:
0
Molecular Weight:
273.244g/mol
Monoisotopic Mass:
273.064g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
81.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.