O-Trityl-L-serine

CAT: 0127-OR1065360-01Size: 5 gDry Ice: NoHazardous: No

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CAT#:0127-OR1065360-01Size:5 g

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CAS Number

25840-83-9

MDL Number

MFCD30187617

Purity

97% ï¼ˆcontains~5.0% waterï¼‰

Smiles

N[C@@H](COC(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3)C(O)=O

Chemical Information

O-Trityl-L-serine

CAS Number	25840-83-9
PubChem CID	13943580
IUPAC Name	(2S)-2-amino-3-trityloxypropanoic acid
Molecular Formula	C22H21NO3
Molecular Weight	347.4
XLogP	1.2
Topological Polar Surface Area	72.6
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	7
Heavy Atom Count	26
Formal Charge	0
Complexity	389

SMILES

C1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)OC[C@@H](C(=O)O)N

InChI

InChI=1S/C22H21NO3/c23-20(21(24)25)16-26-22(17-10-4-1-5-11-17,18-12-6-2-7-13-18)19-14-8-3-9-15-19/h1-15,20H,16,23H2,(H,24,25)/t20-/m0/s1

InChIKey

ZXVRNLZMMUBFSR-FQEVSTJZSA-N

Chemical Structure

2D Structure

CAS: 25840-83-9

CID: 13943580

Formula: C22H21NO3

MW: 347.4

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	347.4
XLogP3	1.2
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	7
Exact Mass	347.15214353
Monoisotopic Mass	347.15214353
Topological Polar Surface Area	72.6 Å²
Heavy Atom Count	26
Formal Charge	0
Complexity	389
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

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