Home Other Building Blocks 2-(propan-2-yl)-1,4-oxazepane

2-(propan-2-yl)-1,4-oxazepane

CAS No.:
1508439-86-8
Catalog Number:
AG01AMYQ
Molecular Formula:
C8H17NO
Molecular Weight:
143.2267
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Product Description
Catalog Number:
AG01AMYQ
Chemical Name:
2-(propan-2-yl)-1,4-oxazepane
CAS Number:
1508439-86-8
Molecular Formula:
C8H17NO
Molecular Weight:
143.2267
MDL Number:
MFCD29034077
IUPAC Name:
2-propan-2-yl-1,4-oxazepane
InChI:
InChI=1S/C8H17NO/c1-7(2)8-6-9-4-3-5-10-8/h7-9H,3-6H2,1-2H3
InChI Key:
JPYYBLAUULIEFR-UHFFFAOYSA-N
SMILES:
CC(C1CNCCCO1)C
Properties
Complexity:
93.3  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
143.131g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
143.23g/mol
Monoisotopic Mass:
143.131g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
21.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  
Properties