Cis-4-Isopropylcyclohexanecarboxylic Acid

CAT: 0024-sc-489085Size: 100 mgDry Ice: NoHazardous: No

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CAT#:0024-sc-489085Size:100 mg

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CAS Number

7084-93-7

Chemical Information

4-Isopropylcyclohexanecarboxylic Acid

CAS Number	7084-93-7
PubChem CID	81526
IUPAC Name	4-propan-2-ylcyclohexane-1-carboxylic acid
Molecular Formula	C10H18O2
Molecular Weight	170.25
XLogP	2.9
Topological Polar Surface Area	37.3
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	2
Heavy Atom Count	12
Formal Charge	0
Complexity	155

SMILES

CC(C)C1CCC(CC1)C(=O)O

InChI

InChI=1S/C10H18O2/c1-7(2)8-3-5-9(6-4-8)10(11)12/h7-9H,3-6H2,1-2H3,(H,11,12)

InChIKey

YRQKWRUZZCBSIG-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 7084-93-7

CID: 81526

Formula: C10H18O2

MW: 170.25

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	170.25
XLogP3	2.9
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	2
Exact Mass	170.130679813
Monoisotopic Mass	170.130679813
Topological Polar Surface Area	37.3 Å²
Heavy Atom Count	12
Formal Charge	0
Complexity	155
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
sc-286821A	Trans 4-Isopropylcyclohexanecarboxylic acid
sc-286821	Trans 4-Isopropylcyclohexanecarboxylic acid
sc-490553C	Cis-4-Hydroxycinnamic acid
sc-486903	Cis-4-Hydroxycyclohexanecarboxylic Acid
sc-490553B	Cis-4-Hydroxycinnamic acid
sc-267774	4,4'-cis-Stilbenedicarboxylic acid
sc-255026	Cis-4-Aminocyclohexanecarboxylic acid
sc-490553A	Cis-4-Hydroxycinnamic acid
sc-490553	Cis-4-Hydroxycinnamic acid
sc-234397	Cis, cis, cis, cis-1,2,3,4-Cyclopentanetetracarboxylic acid

Catalog	Name
HAA08493-01	Cis-4-Isopropylcyclohexanecarboxylic acid
TRC-I824400-1G	trans-4-Isopropylcyclohexanecarboxylic Acid
HY-W042292R	Trans-4-Isopropylcyclohexanecarboxylic acid (Standard)
FH24323-01	Cis-4-Hydroxycinnamic acid
abx180709-01	cis-4-Aminocyclohexanecarboxylic acid
BIBP1023-01	Cis-4-azidocyclohexanecarboxylic acid
FH154445-01	Cis-4-Hydroxycyclohexanecarboxylic acid
OR1067837-01	Cis-4-Methylcyclohexanecarboxylic acid
H9117-87C	N-Hydroxysuccinimidyl-trans-4-isopropylcyclohexanecarboxylate (4-trans-Isopropylcyclohexanecarboxylic Acid, N-Succunimidyl Ester)
411761-01	(11-cis,13-cis) -4-Oxoretinoic Acid