Boc-D-Cha-OH hydrate

CAT: 0024-sc-227448Size: 1 gDry Ice: NoHazardous: No

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CAT#:0024-sc-227448Size:1 g

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CAS Number

127095-92-5

Chemical Information

(2R)-2-{[(tert-butoxy)carbonyl]amino}-3-cyclohexylpropanoic acid

CAS Number	127095-92-5
PubChem CID	2755927
IUPAC Name	(2R)-3-cyclohexyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid
Molecular Formula	C14H25NO4
Molecular Weight	271.35
XLogP	3.7
Topological Polar Surface Area	75.6
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	6
Heavy Atom Count	19
Formal Charge	0
Complexity	316

SMILES

CC(C)(C)OC(=O)N[C@H](CC1CCCCC1)C(=O)O

InChI

InChI=1S/C14H25NO4/c1-14(2,3)19-13(18)15-11(12(16)17)9-10-7-5-4-6-8-10/h10-11H,4-9H2,1-3H3,(H,15,18)(H,16,17)/t11-/m1/s1

InChIKey

MSZQAQJBXGTSHP-LLVKDONJSA-N

Chemical Structure

2D Structure

CAS: 127095-92-5

CID: 2755927

Formula: C14H25NO4

MW: 271.35

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	271.35
XLogP3	3.7
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	6
Exact Mass	271.17835828
Monoisotopic Mass	271.17835828
Topological Polar Surface Area	75.6 Å²
Heavy Atom Count	19
Formal Charge	0
Complexity	316
Isotope Atom Count	0
Defined Atom Stereocenter Count	1
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
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443296-01	Boc-Lys (Me) 2-OH Hydrate
B656853	Boc-Lys(Me)2-OH Hydrate
G-1340.0250	H-D-Ala-D-Phe-OH hydrate
264621-01	N-alpha-Boc-D-arginine hydrochloride hydrate
236201-01	Boc-D-leucine hydrate ≥98.5% (HPLC)
240298-01	Na-Boc-D-arginine hydrochloride hydrate 98+% (HPLC)
265059-01	Boc-DL-leucine hydrate