Home Other Building Blocks {4-methyl-2-oxabicyclo[2.1.1]hexan-1-yl}methanamine

{4-methyl-2-oxabicyclo[2.1.1]hexan-1-yl}methanamine

CAS No.:
2138031-00-0
Catalog Number:
AG01EJOX
Molecular Formula:
C7H13NO
Molecular Weight:
127.1842
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Product Description
Catalog Number:
AG01EJOX
Chemical Name:
{4-methyl-2-oxabicyclo[2.1.1]hexan-1-yl}methanamine
CAS Number:
2138031-00-0
Molecular Formula:
C7H13NO
Molecular Weight:
127.1842
MDL Number:
MFCD31559483
IUPAC Name:
(4-methyl-2-oxabicyclo[2.1.1]hexan-1-yl)methanamine
InChI:
InChI=1S/C7H13NO/c1-6-2-7(3-6,4-8)9-5-6/h2-5,8H2,1H3
InChI Key:
CEAFNAZSKXWJNK-UHFFFAOYSA-N
SMILES:
NCC12OCC(C1)(C2)C
Properties
Complexity:
138  
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