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141774-70-1 | Carbamic acid, N-[(2S)-2-pyrrolidinylmethyl]-, 1,1-dimethylethyl ester
CAS No: 141774-70-1 Catalog No: AG001H1A MDL No:MFCD06796572
Product Description
Catalog Number:
AG001H1A
Chemical Name:
Carbamic acid, N-[(2S)-2-pyrrolidinylmethyl]-, 1,1-dimethylethyl ester
CAS Number:
141774-70-1
Molecular Formula:
C10H20N2O2
Molecular Weight:
200.2780
MDL Number:
MFCD06796572
IUPAC Name:
tert-butyl N-[[(2S)-pyrrolidin-2-yl]methyl]carbamate
InChI:
InChI=1S/C10H20N2O2/c1-10(2,3)14-9(13)12-7-8-5-4-6-11-8/h8,11H,4-7H2,1-3H3,(H,12,13)/t8-/m0/s1
InChI Key:
DPJPFGHHTJLWQQ-QMMMGPOBSA-N
SMILES:
O=C(OC(C)(C)C)NC[C@@H]1CCCN1
Properties
Complexity:
199
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
200.152g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
200.282g/mol
Monoisotopic Mass:
200.152g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
50.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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