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375853-79-5 | tert-Butyl (5-iodopyridin-2-yl)carbamate
CAS No: 375853-79-5 Catalog No: AG003UIX MDL No:MFCD03791267
Product Description
Catalog Number:
AG003UIX
Chemical Name:
tert-Butyl (5-iodopyridin-2-yl)carbamate
CAS Number:
375853-79-5
Molecular Formula:
C10H13IN2O2
Molecular Weight:
320.1269
MDL Number:
MFCD03791267
IUPAC Name:
tert-butyl N-(5-iodopyridin-2-yl)carbamate
InChI:
InChI=1S/C10H13IN2O2/c1-10(2,3)15-9(14)13-8-5-4-7(11)6-12-8/h4-6H,1-3H3,(H,12,13,14)
InChI Key:
YZLXIVKPYUFJPN-UHFFFAOYSA-N
SMILES:
O=C(OC(C)(C)C)Nc1ccc(cn1)I
Properties
Complexity:
228
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
320.002g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
320.13g/mol
Monoisotopic Mass:
320.002g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
51.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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