Name: Name:1-[(tert-butoxy)carbonyl]cycloheptane-1-carboxylic acid
Brand: Angene
SKU: AG01C6KD
Rating: 90 (10 reviews)

1-[(tert-butoxy)carbonyl]cycloheptane-1-carboxylic acid

CAS No.:

1989672-44-7

Catalog Number:

AG01C6KD

Molecular Formula:

C13H22O4

Molecular Weight:

242.3114

Catalog Number:

AG01C6KD

Chemical Name:

1-[(tert-butoxy)carbonyl]cycloheptane-1-carboxylic acid

CAS Number:

1989672-44-7

Molecular Formula:

C13H22O4

Molecular Weight:

242.3114

MDL Number:

MFCD30342685

IUPAC Name:

1-[(2-methylpropan-2-yl)oxycarbonyl]cycloheptane-1-carboxylic acid

InChI:

InChI=1S/C13H22O4/c1-12(2,3)17-11(16)13(10(14)15)8-6-4-5-7-9-13/h4-9H2,1-3H3,(H,14,15)

InChI Key:

RJSLYLOJHRCPMC-UHFFFAOYSA-N

SMILES:

O=C(C1(CCCCCC1)C(=O)O)OC(C)(C)C

Complexity:

293

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

242.152g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

242.315g/mol

Monoisotopic Mass:

242.152g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

63.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.3