Home Carboxys methyl 1-tert-butylazetidine-2-carboxylate

methyl 1-tert-butylazetidine-2-carboxylate

CAS No.:
18085-35-3
Catalog Number:
AG00I0A8
Molecular Formula:
C9H17NO2
Molecular Weight:
171.2368
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Product Description
Catalog Number:
AG00I0A8
Chemical Name:
methyl 1-tert-butylazetidine-2-carboxylate
CAS Number:
18085-35-3
Molecular Formula:
C9H17NO2
Molecular Weight:
171.2368
MDL Number:
MFCD06804435
IUPAC Name:
methyl 1-tert-butylazetidine-2-carboxylate
InChI:
InChI=1S/C9H17NO2/c1-9(2,3)10-6-5-7(10)8(11)12-4/h7H,5-6H2,1-4H3
InChI Key:
ZNMJVYVCCXSTAT-UHFFFAOYSA-N
SMILES:
COC(=O)C1CCN1C(C)(C)C
Properties
Complexity:
184  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
171.126g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
171.24g/mol
Monoisotopic Mass:
171.126g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  
Properties