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56523-47-8 molecular structure
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(2R)-2-phenylpyrrolidine

ChemBase ID: 811277
Molecular Formular: C10H13N
Molecular Mass: 147.21692
Monoisotopic Mass: 147.10479942
SMILES and InChIs

SMILES:
N1[C@H](CCC1)c1ccccc1
Canonical SMILES:
C1CN[C@H](C1)c1ccccc1
InChI:
InChI=1S/C10H13N/c1-2-5-9(6-3-1)10-7-4-8-11-10/h1-3,5-6,10-11H,4,7-8H2/t10-/m1/s1
InChIKey:
JUTDHSGANMHVIC-SNVBAGLBSA-N

Cite this record

CBID:811277 http://www.chembase.cn/molecule-811277.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
(2R)-2-phenylpyrrolidine
IUPAC Traditional name
(2R)-2-phenylpyrrolidine
Synonyms
(R)-2-PHENYLPYRROLIDINE
CAS Number
56523-47-8

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID
A&J Pharmtech AJA-O30461 external link Add to cart
Data Source Data ID Price
A&J Pharmtech
AJA-O30461 external link Add to cart Please log in.
Data Source Data ID

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) -1.2399172  LogD (pH = 7.4) -0.96401614 
Log P 1.9971591  Molar Refractivity 46.5172 cm3
Polarizability 18.54361 Å3 Polar Surface Area 12.03 Å2
Rotatable Bonds Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Product Information Bioassay(PubChem)
Purity
98% expand Show data source

DETAILS

DETAILS

REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

INTERNET

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