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191348-04-6

191348-04-6 | 1-Pyrrolidinecarboxylic acid, 3-formyl-, 1,1-dimethylethyl ester, (3S)-

CAS No: 191348-04-6 Catalog No: AG002F60 MDL No:MFCD14635729

Product Description

Catalog Number:
AG002F60
Chemical Name:
1-Pyrrolidinecarboxylic acid, 3-formyl-, 1,1-dimethylethyl ester, (3S)-
CAS Number:
191348-04-6
Molecular Formula:
C10H17NO3
Molecular Weight:
199.2469
MDL Number:
MFCD14635729
IUPAC Name:
tert-butyl (3S)-3-formylpyrrolidine-1-carboxylate
InChI:
InChI=1S/C10H17NO3/c1-10(2,3)14-9(13)11-5-4-8(6-11)7-12/h7-8H,4-6H2,1-3H3/t8-/m0/s1
InChI Key:
DWLADVOODHZCFV-QMMMGPOBSA-N
SMILES:
O=C[C@H]1CCN(C1)C(=O)OC(C)(C)C

Properties

Complexity:
232  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
199.121g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
199.25g/mol
Monoisotopic Mass:
199.121g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
46.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7  

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