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Home > Fluorides > 1407991-26-7
1407991-26-7 | Carbamic acid, N-[[(2R)-4,4-difluoro-2-pyrrolidinyl]methyl]-, 1,1-dimethylethyl ester
CAS No: 1407991-26-7 Catalog No: AG001CRM MDL No:MFCD28502526
Product Description
Catalog Number:
AG001CRM
Chemical Name:
Carbamic acid, N-[[(2R)-4,4-difluoro-2-pyrrolidinyl]methyl]-, 1,1-dimethylethyl ester
CAS Number:
1407991-26-7
Molecular Formula:
C10H18F2N2O2
Molecular Weight:
236.2589
MDL Number:
MFCD28502526
IUPAC Name:
tert-butyl N-[[(2R)-4,4-difluoropyrrolidin-2-yl]methyl]carbamate
InChI:
InChI=1S/C10H18F2N2O2/c1-9(2,3)16-8(15)13-5-7-4-10(11,12)6-14-7/h7,14H,4-6H2,1-3H3,(H,13,15)/t7-/m1/s1
InChI Key:
KEWAAHJOSNDLHV-SSDOTTSWSA-N
SMILES:
O=C(OC(C)(C)C)NC[C@@H]1NCC(C1)(F)F
Properties
Complexity:
264
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
236.134g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
236.263g/mol
Monoisotopic Mass:
236.134g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
50.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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