2-butylbenzonitrile

Modify Date: 2025-09-12 12:32:11

2-butylbenzonitrile Structure
2-butylbenzonitrile structure
Common Name 2-butylbenzonitrile
CAS Number 57775-05-0 Molecular Weight 159.22800
Density N/A Boiling Point N/A
Molecular Formula C11H13N Melting Point N/A
MSDS N/A Flash Point N/A

 Names

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

Name 2-butylbenzonitrile
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.

Molecular Formula C11H13N
Molecular Weight 159.22800
Exact Mass 159.10500
PSA 23.79000
LogP 2.90088
InChIKey CQKKTUCVEOBIBW-UHFFFAOYSA-N
SMILES CCCCc1ccccc1C#N

 Synthetic Route

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

~91%

2-butylbenzonitrile Structure

2-butylbenzonitrile

CAS#:57775-05-0

Learn More
Literature: Kondolff, Isabelle; Doucet, Henri; Santelli, Maurice Tetrahedron, 2004 , vol. 60, # 17 p. 3813 - 3818

~67%

2-butylbenzonitrile Structure

2-butylbenzonitrile

CAS#:57775-05-0

Learn More
Literature: Zhang, Line; Ang, Gim Yean; Chiba, Shunsuke Organic Letters, 2011 , vol. 13, # 7 p. 1622 - 1625

~58%

2-butylbenzonitrile Structure

2-butylbenzonitrile

CAS#:57775-05-0

Learn More
Literature: Cahiez, Gerard; Lepifre, Franck; Ramiandrasoa, Parfait Synthesis, 1999 , # 12 p. 2138 - 2144

~44%

2-butylbenzonitrile Structure

2-butylbenzonitrile

CAS#:57775-05-0

Learn More
Literature: Kyushin, Soichiro; Masuda, Yukihiro; Matsushita, Kazuhiro; Nakadaira, Yasuhiro; Ohashi, Mamoru Tetrahedron Letters, 1990 , vol. 31, # 44 p. 6395 - 6398

~43%

2-butylbenzonitrile Structure

2-butylbenzonitrile

CAS#:57775-05-0

Learn More
Literature: Kyushin, Soichiro; Masuda, Yukihiro; Matsushita, Kazuhiro; Nakadaira, Yasuhiro; Ohashi, Mamoru Tetrahedron Letters, 1990 , vol. 31, # 44 p. 6395 - 6398

~38%

2-butylbenzonitrile Structure

2-butylbenzonitrile

CAS#:57775-05-0

Learn More
Literature: Kyushin, Soichiro; Masuda, Yukihiro; Matsushita, Kazuhiro; Nakadaira, Yasuhiro; Ohashi, Mamoru Tetrahedron Letters, 1990 , vol. 31, # 44 p. 6395 - 6398

 Synonyms

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

Benzonitrile,2-butyl
o-Butyl-benzonitril
2-n-butylbenzonitrile
2-butylbenzenecarbonitrile

 2-butylbenzonitrile | FAQ

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

Q: What English synonyms does 2-butylbenzonitrile have?
A: English synonyms of 2-butylbenzonitrile: Benzonitrile,2-butyl, o-Butyl-benzonitril, 2-n-butylbenzonitrile, 2-butylbenzenecarbonitrile.
Q: What are the upstream materials of 2-butylbenzonitrile?
A: Related upstream materials(CAS) of 2-butylbenzonitrile: 4426-47-5;2042-37-7;693-03-8;873-32-5;1461-25-2;91-15-6;1067-42-1;994-79-6.
Q: What is the InChIKey of 2-butylbenzonitrile?
A: InChIKey of 2-butylbenzonitrile is CQKKTUCVEOBIBW-UHFFFAOYSA-N.
Q: What is the English name of 2-butylbenzonitrile?
A: The English name of 2-butylbenzonitrile is 2-butylbenzonitrile.
Q: What is the CAS number of 2-butylbenzonitrile?
A: CAS number of 2-butylbenzonitrile is 57775-05-0.
Q: What is the SMILES notation of 2-butylbenzonitrile?
A: SMILES notation of 2-butylbenzonitrile is CCCCc1ccccc1C#N.
Q: What is the LogP of 2-butylbenzonitrile?
A: LogP of 2-butylbenzonitrile is 2.90088.
Q: What is the Chinese name of 57775-05-0?
A: Chinese name of 57775-05-0 is 57775-05-0.
Q: What is the polar surface area (PSA) of 2-butylbenzonitrile?
A: Polar surface area (PSA) of 2-butylbenzonitrile is 23.79000.
Q: What is the molecular weight of 2-butylbenzonitrile?
A: Molecular weight of 2-butylbenzonitrile is 159.22800.
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