Home Other Building Blocks 2-([(TERT-BUTOXY)CARBONYL]AMINO)-3-(CYCLOHEX-3-EN-1-YL)PROPANOIC ACID

2-([(TERT-BUTOXY)CARBONYL]AMINO)-3-(CYCLOHEX-3-EN-1-YL)PROPANOIC ACID

CAS No.:
1379859-23-0
Catalog Number:
AG01EM42
Molecular Formula:
C14H23NO4
Molecular Weight:
269.3367
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Product Description
Catalog Number:
AG01EM42
Chemical Name:
2-([(TERT-BUTOXY)CARBONYL]AMINO)-3-(CYCLOHEX-3-EN-1-YL)PROPANOIC ACID
CAS Number:
1379859-23-0
Molecular Formula:
C14H23NO4
Molecular Weight:
269.3367
MDL Number:
MFCD09916364
IUPAC Name:
3-cyclohex-3-en-1-yl-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid
InChI:
InChI=1S/C14H23NO4/c1-14(2,3)19-13(18)15-11(12(16)17)9-10-7-5-4-6-8-10/h4-5,10-11H,6-9H2,1-3H3,(H,15,18)(H,16,17)
InChI Key:
PABLWCRQESJOMP-UHFFFAOYSA-N
SMILES:
O=C(OC(C)(C)C)NC(C(=O)O)CC1CCC=CC1
Properties
Complexity:
357  
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:
2  
Isotope Atom Count:
0
Molecular Weight:
269.341g/mol
Monoisotopic Mass:
269.163g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
75.6A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  
Properties