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Home > Other Heterocycles > 1803565-97-0
1803565-97-0 | tert-butyl N-{3-formylbicyclo[2.2.1]heptan-2-yl}carbamate
CAS No: 1803565-97-0 Catalog No: AG01BEYK MDL No:MFCD24533982
Product Description
Catalog Number:
AG01BEYK
Chemical Name:
tert-butyl N-{3-formylbicyclo[2.2.1]heptan-2-yl}carbamate
CAS Number:
1803565-97-0
Molecular Formula:
C13H21NO3
Molecular Weight:
239.3107
MDL Number:
MFCD24533982
IUPAC Name:
tert-butyl N-(3-formyl-2-bicyclo[2.2.1]heptanyl)carbamate
InChI:
InChI=1S/C13H21NO3/c1-13(2,3)17-12(16)14-11-9-5-4-8(6-9)10(11)7-15/h7-11H,4-6H2,1-3H3,(H,14,16)
InChI Key:
UQRDWBUTDRBGSD-UHFFFAOYSA-N
SMILES:
O=CC1C2CCC(C1NC(=O)OC(C)(C)C)C2
Properties
Complexity:
321
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
239.152g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
239.315g/mol
Monoisotopic Mass:
239.152g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
55.4A^2
Undefined Atom Stereocenter Count:
4
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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