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1217838-01-1 | Carbamic acid, N-[3-(2R)-2-pyrrolidinylpropyl]-, 1,1-dimethylethyl ester
CAS No: 1217838-01-1 Catalog No: AG00160O MDL No:MFCD06656824
Product Description
Catalog Number:
AG00160O
Chemical Name:
Carbamic acid, N-[3-(2R)-2-pyrrolidinylpropyl]-, 1,1-dimethylethyl ester
CAS Number:
1217838-01-1
Molecular Formula:
C12H24N2O2
Molecular Weight:
228.3312
MDL Number:
MFCD06656824
IUPAC Name:
tert-butyl N-[3-[(2R)-pyrrolidin-2-yl]propyl]carbamate
InChI:
InChI=1S/C12H24N2O2/c1-12(2,3)16-11(15)14-9-5-7-10-6-4-8-13-10/h10,13H,4-9H2,1-3H3,(H,14,15)/t10-/m1/s1
InChI Key:
PBGQRRIIQREOFN-SNVBAGLBSA-N
SMILES:
O=C(OC(C)(C)C)NCCC[C@H]1CCCN1
Properties
Complexity:
224
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
228.184g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
228.336g/mol
Monoisotopic Mass:
228.184g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
50.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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