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59379-02-1 | 1-Boc-3-Pyrrolidinecarbaldehyde
CAS No: 59379-02-1 Catalog No: AG0032OY MDL No:MFCD03791257
Product Description
Catalog Number:
AG0032OY
Chemical Name:
1-Boc-3-Pyrrolidinecarbaldehyde
CAS Number:
59379-02-1
Molecular Formula:
C10H17NO3
Molecular Weight:
199.2469
MDL Number:
MFCD03791257
IUPAC Name:
tert-butyl 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
InChI Key:
DWLADVOODHZCFV-UHFFFAOYSA-N
SMILES:
O=CC1CCN(C1)C(=O)OC(C)(C)C
Properties
Complexity:
232
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
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:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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