1-butyl-3-[(4-chlorophenyl)-phenyl-methoxy]pyrrolidine

Modify Date: 2026-08-14 21:00:29

1-butyl-3-[(4-chlorophenyl)-phenyl-methoxy]pyrrolidine Structure
1-butyl-3-[(4-chlorophenyl)-phenyl-methoxy]pyrrolidine structure
Common Name 1-butyl-3-[(4-chlorophenyl)-phenyl-methoxy]pyrrolidine
CAS Number 102446-17-3 Molecular Weight 343.89000
Density 1.13g/cm3 Boiling Point 433.5ºC at 760mmHg
Molecular Formula C21H26ClNO Melting Point N/A
MSDS N/A Flash Point 216ºC

Summary: 1-Butyl-3-[(4-chlorophenyl)-phenyl-methoxy]pyrrolidine, Chinese name 1-丁基-3-[(4-氯苯基)-苯甲氧基]吡咯烷, CAS number 102446-17-3, molecular formula C21H26ClNO, molecular weight 343.89. For research-use only, not for medical or clinical usage.


 Names

This table lists Chinese names, IUPAC names and various aliases of this chemical substance.

Name 1-butyl-3-[(4-chlorophenyl)-phenylmethoxy]pyrrolidine
Synonym More Synonyms

 Chemical & Physical Properties

This table shows physicochemical parameters including melting point, boiling point, density, solubility and optical rotation. Missing data is marked as N/A.

Density 1.13g/cm3
Boiling Point 433.5ºC at 760mmHg
Molecular Formula C21H26ClNO
Molecular Weight 343.89000
Flash Point 216ºC
Exact Mass 343.17000
PSA 12.47000
LogP 5.25830
Vapour Pressure 1.02E-07mmHg at 25°C
Index of Refraction 1.583
InChIKey LDCAVJYDEQRFHB-UHFFFAOYSA-N
SMILES CCCCN1CCC(OC(c2ccccc2)c2ccc(Cl)cc2)C1

 Toxicological Information

This table summarizes toxicological test data, acute & chronic toxicity and ecological hazard parameters for this chemical.

CHEMICAL IDENTIFICATION

RTECS NUMBER :
UY0705100
CHEMICAL NAME :
Pyrrolidine, 3-(p-chloro-alpha-phenylbenzyloxy)-1-butyl-
CAS REGISTRY NUMBER :
102446-17-3
BEILSTEIN REFERENCE NO. :
0281898
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C21-H26-Cl-N-O
MOLECULAR WEIGHT :
343.93
WISWESSER LINE NOTATION :
T5NTJ A4 COYR&R DG

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
20 mg/kg
TOXIC EFFECTS :
Behavioral - tremor Behavioral - convulsions or effect on seizure threshold Behavioral - muscle contraction or spasticity
REFERENCE :
JMPCAS Journal of Medicinal and Pharmaceutical Chemistry. (Washington, DC) V.1-5, 1959-62. For publisher information, see JMCMAR. Volume(issue)/page/year: 1,73,1959

 Synthetic Route

This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.

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1-butyl-3-[(4-chlorophenyl)-phenyl-methoxy]pyrrolidine Structure

1-butyl-3-[(4-c...

CAS#:102446-17-3

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Literature: Lunsford et al. Journal of Medicinal and Pharmaceutical Chemistry, 1959 , vol. 1, p. 73,78,80,81

 Synonyms

This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.

ahr 225

  | FAQ

This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.

Q: What is the molecular weight of 1-butyl-3-[(4-chlorophenyl)-phenylmethoxy]pyrrolidine?
A: Molecular weight of 1-butyl-3-[(4-chlorophenyl)-phenylmethoxy]pyrrolidine is 343.89000.
Q: What is the SMILES notation of 1-butyl-3-[(4-chlorophenyl)-phenylmethoxy]pyrrolidine?
A: SMILES notation of 1-butyl-3-[(4-chlorophenyl)-phenylmethoxy]pyrrolidine is CCCCN1CCC(OC(c2ccccc2)c2ccc(Cl)cc2)C1.
Q: What is the boiling point of 1-butyl-3-[(4-chlorophenyl)-phenylmethoxy]pyrrolidine?
A: Boiling point of 1-butyl-3-[(4-chlorophenyl)-phenylmethoxy]pyrrolidine is 433.5ºC at 760mmHg.
Q: What is the polar surface area (PSA) of 1-butyl-3-[(4-chlorophenyl)-phenylmethoxy]pyrrolidine?
A: Polar surface area (PSA) of 1-butyl-3-[(4-chlorophenyl)-phenylmethoxy]pyrrolidine is 12.47000.
Q: What is the InChIKey of 1-butyl-3-[(4-chlorophenyl)-phenylmethoxy]pyrrolidine?
A: InChIKey of 1-butyl-3-[(4-chlorophenyl)-phenylmethoxy]pyrrolidine is LDCAVJYDEQRFHB-UHFFFAOYSA-N.
Q: What is the Chinese name of 102446-17-3?
A: Chinese name of 102446-17-3 is 102446-17-3.
Q: What is the LogP of 1-butyl-3-[(4-chlorophenyl)-phenylmethoxy]pyrrolidine?
A: LogP of 1-butyl-3-[(4-chlorophenyl)-phenylmethoxy]pyrrolidine is 5.25830.
Q: What is the molecular formula of 1-butyl-3-[(4-chlorophenyl)-phenylmethoxy]pyrrolidine?
A: Molecular formula of 1-butyl-3-[(4-chlorophenyl)-phenylmethoxy]pyrrolidine is C21H26ClNO.
Q: What English synonyms does 1-butyl-3-[(4-chlorophenyl)-phenylmethoxy]pyrrolidine have?
A: English synonyms of 1-butyl-3-[(4-chlorophenyl)-phenylmethoxy]pyrrolidine: ahr 225.
Q: What is the English name of 1-butyl-3-[(4-chlorophenyl)-phenylmethoxy]pyrrolidine?
A: The English name of 1-butyl-3-[(4-chlorophenyl)-phenylmethoxy]pyrrolidine is 1-butyl-3-[(4-chlorophenyl)-phenylmethoxy]pyrrolidine.

 factory

This table lists manufacturers and suppliers of this compound, including vendor names and product supply reference information.

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