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263409-80-9 | Carbamic acid, [2-(2-cyanophenoxy)ethyl]-, 1,1-dimethylethyl ester (9CI)
CAS No: 263409-80-9 Catalog No: AG002STM MDL No:MFCD18070983
Product Description
Catalog Number:
AG002STM
Chemical Name:
Carbamic acid, [2-(2-cyanophenoxy)ethyl]-, 1,1-dimethylethyl ester (9CI)
CAS Number:
263409-80-9
Molecular Formula:
C14H18N2O3
Molecular Weight:
262.3043
MDL Number:
MFCD18070983
IUPAC Name:
tert-butyl N-[2-(2-cyanophenoxy)ethyl]carbamate
InChI:
InChI=1S/C14H18N2O3/c1-14(2,3)19-13(17)16-8-9-18-12-7-5-4-6-11(12)10-15/h4-7H,8-9H2,1-3H3,(H,16,17)
InChI Key:
CLDHGNUTHNBJFF-UHFFFAOYSA-N
SMILES:
N#Cc1ccccc1OCCNC(=O)OC(C)(C)C
Properties
Complexity:
340
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
262.132g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
262.309g/mol
Monoisotopic Mass:
262.132g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
71.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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