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20042-98-2 | 1,4-Benzenediol, 2,6-dimethyl-, 1,4-bis(N-methylcarbamate)
CAS No: 20042-98-2 Catalog No: AG002CRG MDL No:
Product Description
Catalog Number:
AG002CRG
Chemical Name:
1,4-Benzenediol, 2,6-dimethyl-, 1,4-bis(N-methylcarbamate)
CAS Number:
20042-98-2
IUPAC Name:
[3,5-dimethyl-4-(methylcarbamoyloxy)phenyl] N-methylcarbamate
InChI:
InChI=1S/C12H16N2O4/c1-7-5-9(17-11(15)13-3)6-8(2)10(7)18-12(16)14-4/h5-6H,1-4H3,(H,13,15)(H,14,16)
InChI Key:
VXXWRRRGSTWOCL-UHFFFAOYSA-N
NSC Number:
11846
Properties
Complexity:
297
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
252.111g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
252.27g/mol
Monoisotopic Mass:
252.111g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
76.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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