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1215071-23-0 | Carbamic acid, N-(3,3-difluorocyclopentyl)-, 1,1-dimethylethyl ester
CAS No: 1215071-23-0 Catalog No: AG001549 MDL No:MFCD16657108
Product Description
Catalog Number:
AG001549
Chemical Name:
Carbamic acid, N-(3,3-difluorocyclopentyl)-, 1,1-dimethylethyl ester
CAS Number:
1215071-23-0
Molecular Formula:
C10H17F2NO2
Molecular Weight:
221.2443
MDL Number:
MFCD16657108
IUPAC Name:
tert-butyl N-(3,3-difluorocyclopentyl)carbamate
InChI:
InChI=1S/C10H17F2NO2/c1-9(2,3)15-8(14)13-7-4-5-10(11,12)6-7/h7H,4-6H2,1-3H3,(H,13,14)
InChI Key:
SCXQXMBCRMLPGO-UHFFFAOYSA-N
SMILES:
O=C(OC(C)(C)C)NC1CCC(C1)(F)F
Properties
Complexity:
248
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
221.123g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
221.248g/mol
Monoisotopic Mass:
221.123g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
38.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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