2-Amino-1-[4-(methylsulfonyl)phenyl]propane-1,3-diol, (1R,2R)-

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Details

Stereochemistry	ABSOLUTE
Molecular Formula	C10H15NO4S
Molecular Weight	245.295
Optical Activity	UNSPECIFIED
Defined Stereocenters	2 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 2-Amino-1-[4-(methylsulfonyl)phenyl]propane-1,3-diol, (1R,2R)-

Structure Search

SMILES

CS(=O)(=O)C1=CC=C(C=C1)[C@@H](O)[C@H](N)CO

InChI

InChIKey=CIAZEFCFQFQJLB-NXEZZACHSA-N

InChI=1S/C10H15NO4S/c1-16(14,15)8-4-2-7(3-5-8)10(13)9(11)6-12/h2-5,9-10,12-13H,6,11H2,1H3/t9-,10-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C10H15NO4S
Molecular Weight	245.295
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	2 / 2
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Patents

Patents

Substance Class	Chemical Created by `admin` on `Wed Apr 02 00:08:25 GMT 2025` Edited by `admin` on `Wed Apr 02 00:08:25 GMT 2025`
Record UNII	9CU232E6W2
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

(R(R*,R*)-2-AMINO-1-(P-(METHYLSULPHONYL)PHENYL)PROPANE-1,3-DIOL

Preferred Name

English

2-Amino-1-[4-(methylsulfonyl)phenyl]propane-1,3-diol, (1R,2R)-

Systematic Name

English

1,3-PROPANEDIOL, 2-AMINO-1-(4-(METHYLSULFONYL)PHENYL)-, (1R,2R)-

Systematic Name

English

D-(-)-THREO-2-AMINO-1-(4-METHYLSULFONYL)PHENYL)-1,3-PROPANEDIOL

Systematic Name

English

Code System Code Type Description

CAS

51458-28-7

Created by admin on Wed Apr 02 00:08:25 GMT 2025 , Edited by admin on Wed Apr 02 00:08:25 GMT 2025

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FDA UNII

9CU232E6W2

Created by admin on Wed Apr 02 00:08:25 GMT 2025 , Edited by admin on Wed Apr 02 00:08:25 GMT 2025

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EPA CompTox

DTXSID10199434

Created by admin on Wed Apr 02 00:08:25 GMT 2025 , Edited by admin on Wed Apr 02 00:08:25 GMT 2025

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ECHA (EC/EINECS)

257-216-5

Created by admin on Wed Apr 02 00:08:25 GMT 2025 , Edited by admin on Wed Apr 02 00:08:25 GMT 2025

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PUBCHEM

6452441

Created by admin on Wed Apr 02 00:08:25 GMT 2025 , Edited by admin on Wed Apr 02 00:08:25 GMT 2025

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Related Record Type Details


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(1R,2R)-2-Amino-1-[4-(methanesulfonyl)phenyl-1,3-propanediol hydrochloride

SALT/SOLVATE -> PARENT

Amount: