Z-Sar-OH

CAT: 0024-sc-296853Size: 5 gDry Ice: NoHazardous: No

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CAT#:0024-sc-296853Size:5 g

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CAS Number

39608-31-6

Chemical Information

N-Carbobenzoxysarcosine

CAS Number	39608-31-6
PubChem CID	97053
IUPAC Name	2-[methyl(phenylmethoxycarbonyl)amino]acetic acid
Molecular Formula	C11H13NO4
Molecular Weight	223.22
XLogP	1.8
Topological Polar Surface Area	66.8
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	5
Heavy Atom Count	16
Formal Charge	0
Complexity	248

SMILES

CN(CC(=O)O)C(=O)OCC1=CC=CC=C1

InChI

InChI=1S/C11H13NO4/c1-12(7-10(13)14)11(15)16-8-9-5-3-2-4-6-9/h2-6H,7-8H2,1H3,(H,13,14)

InChIKey

CBWFTZNMONHKNZ-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 39608-31-6

CID: 97053

Formula: C11H13NO4

MW: 223.22

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	223.22
XLogP3	1.8
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	5
Exact Mass	223.08445790
Monoisotopic Mass	223.08445790
Topological Polar Surface Area	66.8 Å²
Heavy Atom Count	16
Formal Charge	0
Complexity	248
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