Home Other Building Blocks 1-Boc-3-Chloromethylpyrrolidine

1-Boc-3-Chloromethylpyrrolidine

CAS No.:
876589-13-8
Catalog Number:
AG004O0O
Molecular Formula:
C10H18ClNO2
Molecular Weight:
219.7084
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Product Description
Catalog Number:
AG004O0O
Chemical Name:
1-Boc-3-Chloromethylpyrrolidine
CAS Number:
876589-13-8
Molecular Formula:
C10H18ClNO2
Molecular Weight:
219.7084
MDL Number:
MFCD08059338
IUPAC Name:
tert-butyl 3-(chloromethyl)pyrrolidine-1-carboxylate
InChI:
InChI=1S/C10H18ClNO2/c1-10(2,3)14-9(13)12-5-4-8(6-11)7-12/h8H,4-7H2,1-3H3
InChI Key:
ZCOBWMKNMWVILV-UHFFFAOYSA-N
SMILES:
ClCC1CCN(C1)C(=O)OC(C)(C)C
Properties
Complexity:
213  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
219.103g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
219.709g/mol
Monoisotopic Mass:
219.103g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  
Properties