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Details

Stereochemistry RACEMIC
Molecular Formula C11H13NO2
Molecular Weight 191.2264
Optical Activity ( + / - )
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of CYCLOPROPANECARBOXYLIC ACID, 2-(AMINOMETHYL)-1-PHENYL-, CIS-

SMILES

NC[C@H]1C[C@]1(C(O)=O)C2=CC=CC=C2

InChI

InChIKey=RKFHJXBVMPGLRG-KOLCDFICSA-N
InChI=1S/C11H13NO2/c12-7-9-6-11(9,10(13)14)8-4-2-1-3-5-8/h1-5,9H,6-7,12H2,(H,13,14)/t9-,11+/m1/s1

HIDE SMILES / InChI

Molecular Formula C11H13NO2
Molecular Weight 191.2264
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 15:46:08 UTC 2023
Edited
by admin
on Sat Dec 16 15:46:08 UTC 2023
Record UNII
N9HI9BH87B
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
CYCLOPROPANECARBOXYLIC ACID, 2-(AMINOMETHYL)-1-PHENYL-, CIS-
Systematic Name English
MILNACIPRAN RELATED COMPOUND A
Common Name English
MILNACIPRAN RELATED COMPOUND A [USP-RS]
Common Name English
Code System Code Type Description
CAS
69160-57-2
Created by admin on Sat Dec 16 15:46:08 UTC 2023 , Edited by admin on Sat Dec 16 15:46:08 UTC 2023
PRIMARY
PUBCHEM
3064679
Created by admin on Sat Dec 16 15:46:08 UTC 2023 , Edited by admin on Sat Dec 16 15:46:08 UTC 2023
PRIMARY
RS_ITEM_NUM
1443668
Created by admin on Sat Dec 16 15:46:08 UTC 2023 , Edited by admin on Sat Dec 16 15:46:08 UTC 2023
PRIMARY
CAS
105310-28-9
Created by admin on Sat Dec 16 15:46:08 UTC 2023 , Edited by admin on Sat Dec 16 15:46:08 UTC 2023
NON-SPECIFIC STEREOCHEMISTRY
EPA CompTox
DTXSID10909419
Created by admin on Sat Dec 16 15:46:08 UTC 2023 , Edited by admin on Sat Dec 16 15:46:08 UTC 2023
PRIMARY
FDA UNII
N9HI9BH87B
Created by admin on Sat Dec 16 15:46:08 UTC 2023 , Edited by admin on Sat Dec 16 15:46:08 UTC 2023
PRIMARY
Related Record Type Details
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