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1260780-38-8 | Carbamic acid, N-[4-(2-hydroxyethyl)-3-pyrrolidinyl]-, 1,1-dimethylethyl ester
CAS No: 1260780-38-8 Catalog No: AG000R7T MDL No:MFCD11847881
Product Description
Catalog Number:
AG000R7T
Chemical Name:
Carbamic acid, N-[4-(2-hydroxyethyl)-3-pyrrolidinyl]-, 1,1-dimethylethyl ester
CAS Number:
1260780-38-8
Molecular Formula:
C11H22N2O3
Molecular Weight:
230.3040
MDL Number:
MFCD11847881
IUPAC Name:
tert-butyl N-[4-(2-hydroxyethyl)pyrrolidin-3-yl]carbamate
InChI:
InChI=1S/C11H22N2O3/c1-11(2,3)16-10(15)13-9-7-12-6-8(9)4-5-14/h8-9,12,14H,4-7H2,1-3H3,(H,13,15)
InChI Key:
QHYUQUJFMRWXNZ-UHFFFAOYSA-N
SMILES:
OCCC1CNCC1NC(=O)OC(C)(C)C
Properties
Complexity:
238
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
230.163g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
230.308g/mol
Monoisotopic Mass:
230.163g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
70.6A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3
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