Home Carboxys 1-Boc-3-allylpiperidine-3-carboxylic acid

1-Boc-3-allylpiperidine-3-carboxylic acid

CAS No.:
959236-11-4
Catalog Number:
AG00IJIR
Molecular Formula:
C14H23NO4
Molecular Weight:
269.3367
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Product Description
Catalog Number:
AG00IJIR
Chemical Name:
1-Boc-3-allylpiperidine-3-carboxylic acid
CAS Number:
959236-11-4
Molecular Formula:
C14H23NO4
Molecular Weight:
269.3367
MDL Number:
MFCD08461330
IUPAC Name:
1-[(2-methylpropan-2-yl)oxycarbonyl]-3-prop-2-enylpiperidine-3-carboxylic acid
InChI:
InChI=1S/C14H23NO4/c1-5-7-14(11(16)17)8-6-9-15(10-14)12(18)19-13(2,3)4/h5H,1,6-10H2,2-4H3,(H,16,17)
InChI Key:
JSILKJJKWZCJME-UHFFFAOYSA-N
SMILES:
C=CCC1(CCCN(C1)C(=O)OC(C)(C)C)C(=O)O
Properties
Complexity:
372  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
269.163g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
269.341g/mol
Monoisotopic Mass:
269.163g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
66.8A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  
Properties