Boc-9-Anc-OH

CAT: 0024-sc-293696ASize: 5 gDry Ice: NoHazardous: No

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CAT#:0024-sc-293696ASize:5 g

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CAS Number

173435-78-4

Chemical Information

9-{[(Tert-butoxy)carbonyl]amino}nonanoic acid

CAS Number	173435-78-4
PubChem CID	4170356
IUPAC Name	9-[(2-methylpropan-2-yl)oxycarbonylamino]nonanoic acid
Molecular Formula	C14H27NO4
Molecular Weight	273.37
XLogP	3.1
Topological Polar Surface Area	75.6
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	11
Heavy Atom Count	19
Formal Charge	0
Complexity	271

SMILES

CC(C)(C)OC(=O)NCCCCCCCCC(=O)O

InChI

InChI=1S/C14H27NO4/c1-14(2,3)19-13(18)15-11-9-7-5-4-6-8-10-12(16)17/h4-11H2,1-3H3,(H,15,18)(H,16,17)

InChIKey

QCCWTNAQYOOPQP-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 173435-78-4

CID: 4170356

Formula: C14H27NO4

MW: 273.37

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	273.37
XLogP3	3.1
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	11
Exact Mass	273.19400834
Monoisotopic Mass	273.19400834
Topological Polar Surface Area	75.6 Å²
Heavy Atom Count	19
Formal Charge	0
Complexity	271
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