Home Other Building Blocks 4-((TERT-BUTOXYCARBONYL)AMINO)-1,2,3,4-TETRAHYDRONAPHTHALENE-1-CARBOXYLIC+

4-((TERT-BUTOXYCARBONYL)AMINO)-1,2,3,4-TETRAHYDRONAPHTHALENE-1-CARBOXYLIC+

CAS No.:
1824346-58-8
Catalog Number:
AG01EKCZ
Molecular Formula:
C16H21NO4
Molecular Weight:
291.3422
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Product Description
Catalog Number:
AG01EKCZ
Chemical Name:
4-((TERT-BUTOXYCARBONYL)AMINO)-1,2,3,4-TETRAHYDRONAPHTHALENE-1-CARBOXYLIC+
CAS Number:
1824346-58-8
Molecular Formula:
C16H21NO4
Molecular Weight:
291.3422
MDL Number:
MFCD21605262
IUPAC Name:
4-[(2-methylpropan-2-yl)oxycarbonylamino]-1,2,3,4-tetrahydronaphthalene-1-carboxylic acid
InChI:
InChI=1S/C16H21NO4/c1-16(2,3)21-15(20)17-13-9-8-12(14(18)19)10-6-4-5-7-11(10)13/h4-7,12-13H,8-9H2,1-3H3,(H,17,20)(H,18,19)
InChI Key:
KSULTRKFBPQDTA-UHFFFAOYSA-N
SMILES:
O=C(OC(C)(C)C)NC1CCC(c2c1cccc2)C(=O)O
Properties
Complexity:
402  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
291.147g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
291.347g/mol
Monoisotopic Mass:
291.147g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
75.6A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  
Properties