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88715-32-6 | Carbamic acid, (4-ethoxy-3-ethylphenyl)-, 1-methylpropyl ester
CAS No: 88715-32-6 Catalog No: AG0045U5 MDL No:
Product Description
Catalog Number:
AG0045U5
Chemical Name:
Carbamic acid, (4-ethoxy-3-ethylphenyl)-, 1-methylpropyl ester
CAS Number:
88715-32-6
Molecular Formula:
C15H23NO3
Molecular Weight:
265.3480
IUPAC Name:
butan-2-yl N-(4-ethoxy-3-ethylphenyl)carbamate
InChI:
InChI=1S/C15H23NO3/c1-5-11(4)19-15(17)16-13-8-9-14(18-7-3)12(6-2)10-13/h8-11H,5-7H2,1-4H3,(H,16,17)
InChI Key:
HBWJZHHNTHRUHF-UHFFFAOYSA-N
SMILES:
CCOc1ccc(cc1CC)NC(=O)OC(CC)C
Properties
Complexity:
270
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
265.168g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
265.353g/mol
Monoisotopic Mass:
265.168g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
47.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
4
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