Home Other Building Blocks {7-oxabicyclo[2.2.1]heptan-1-yl}methanamine

{7-oxabicyclo[2.2.1]heptan-1-yl}methanamine

CAS No.:
2059944-94-2
Catalog Number:
AG01BQAO
Molecular Formula:
C7H13NO
Molecular Weight:
127.1842
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Product Description
Catalog Number:
AG01BQAO
Chemical Name:
{7-oxabicyclo[2.2.1]heptan-1-yl}methanamine
CAS Number:
2059944-94-2
Molecular Formula:
C7H13NO
Molecular Weight:
127.1842
MDL Number:
MFCD30501196
IUPAC Name:
7-oxabicyclo[2.2.1]heptan-1-ylmethanamine
InChI:
InChI=1S/C7H13NO/c8-5-7-3-1-6(9-7)2-4-7/h6H,1-5,8H2
InChI Key:
UHVAPMHYHSSGOJ-UHFFFAOYSA-N
SMILES:
NCC12CCC(O2)CC1
Properties
Complexity:
116  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
127.1g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
127.187g/mol
Monoisotopic Mass:
127.1g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
35.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1  
Properties