Name: Name:trans-4-(trans-4'-Butylcyclohexyl)cyclohexanecarboxylic acid
Brand: Angene
SKU: AG0086W0
Rating: 90 (10 reviews)

trans-4-(trans-4'-Butylcyclohexyl)cyclohexanecarboxylic acid

CAS No.:

89111-63-7

Catalog Number:

AG0086W0

Molecular Formula:

C17H30O2

Molecular Weight:

266.4189

Pack Size

Purity

Availability

Location

Price(USD)

Quantity

>98.0%(GC)(T)

1 week

United States

$164

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Product Description

Catalog Number:

AG0086W0

Chemical Name:

trans-4-(trans-4'-Butylcyclohexyl)cyclohexanecarboxylic acid

CAS Number:

89111-63-7

Molecular Formula:

C17H30O2

Molecular Weight:

266.4189

MDL Number:

MFCD06797517

IUPAC Name:

4-(4-butylcyclohexyl)cyclohexane-1-carboxylic acid

InChI:

InChI=1S/C17H30O2/c1-2-3-4-13-5-7-14(8-6-13)15-9-11-16(12-10-15)17(18)19/h13-16H,2-12H2,1H3,(H,18,19)

InChI Key:

XYKCCZSKCZRZST-UHFFFAOYSA-N

SMILES:

CCCC[C@@H]1CC[C@H](CC1)[C@@H]1CC[C@H](CC1)C(=O)O

EC Number:

618-242-6

Properties

Complexity:

271

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

266.225g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

266.425g/mol

Monoisotopic Mass:

266.225g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

37.3A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

6.2

Literature

Title	Journal
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis.	Bioorganic & medicinal chemistry letters 20101101

Properties