Boc-4-Amc-OH

CAT: 0024-sc-285098Size: 1 gDry Ice: NoHazardous: No

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CAT#:0024-sc-285098Size:1 g

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24/48H Stock Items & 2 to 6 Weeks non Stock Items.

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CAS Number

162046-58-4

Chemical Information

(1r,4r)-4-((((Tert-butoxy)carbonyl)amino)methyl)cyclohexane-1-carboxylic acid

CAS Number	162046-58-4
PubChem CID	736918
IUPAC Name	4-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]cyclohexane-1-carboxylic acid
Molecular Formula	C13H23NO4
Molecular Weight	257.33
XLogP	1.9
Topological Polar Surface Area	75.6
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	5
Heavy Atom Count	18
Formal Charge	0
Complexity	301

SMILES

CC(C)(C)OC(=O)NCC1CCC(CC1)C(=O)O

InChI

InChI=1S/C13H23NO4/c1-13(2,3)18-12(17)14-8-9-4-6-10(7-5-9)11(15)16/h9-10H,4-8H2,1-3H3,(H,14,17)(H,15,16)

InChIKey

AZEKNJGFCSHZID-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 162046-58-4

CID: 736918

Formula: C13H23NO4

MW: 257.33

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	257.33
XLogP3	1.9
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	5
Exact Mass	257.16270821
Monoisotopic Mass	257.16270821
Topological Polar Surface Area	75.6 Å²
Heavy Atom Count	18
Formal Charge	0
Complexity	301
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