Home Other Building Blocks (R)-3-TERT-BUTOXYCARBONYLAMINO-HEPTANOIC ACID

(R)-3-TERT-BUTOXYCARBONYLAMINO-HEPTANOIC ACID

CAS No.:
854102-50-4
Catalog Number:
AG01DSUE
Molecular Formula:
C12H23NO4
Molecular Weight:
245.3153
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Product Description
Catalog Number:
AG01DSUE
Chemical Name:
(R)-3-TERT-BUTOXYCARBONYLAMINO-HEPTANOIC ACID
CAS Number:
854102-50-4
Molecular Formula:
C12H23NO4
Molecular Weight:
245.3153
MDL Number:
MFCD08276224
IUPAC Name:
3-[(2-methylpropan-2-yl)oxycarbonylamino]heptanoic acid
InChI:
InChI=1S/C12H23NO4/c1-5-6-7-9(8-10(14)15)13-11(16)17-12(2,3)4/h9H,5-8H2,1-4H3,(H,13,16)(H,14,15)
InChI Key:
KVAFMJHZXSBEFB-UHFFFAOYSA-N
SMILES:
CCCC[C@@H](NC(=O)OC(C)(C)C)CC(=O)O
Properties
Complexity:
258  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
245.163g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
245.319g/mol
Monoisotopic Mass:
245.163g/mol
Rotatable Bond Count:
8  
Topological Polar Surface Area:
75.6A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  
Properties