N-BOC-Pyrrole

Modify Date: 2024-01-02 10:34:03

N-BOC-Pyrrole Structure
N-BOC-Pyrrole structure
 Common Name N-BOC-Pyrrole
CAS Number 5176-27-2 Molecular Weight 167.205
Density 1 g/mL at 25 °C(lit.) Boiling Point 91-92 °C20 mm Hg(lit.)
Molecular Formula C9H13NO2 Melting Point N/A
MSDS N/A Flash Point 167 °F

 Names

Name t-Butyl 1H-pyrrole-1-carboxylate
Synonym More Synonyms

 Chemical & Physical Properties

Density 1 g/mL at 25 °C(lit.)
Boiling Point 91-92 °C20 mm Hg(lit.)
Molecular Formula C9H13NO2
Molecular Weight 167.205
Flash Point 167 °F
Exact Mass 167.094635
PSA 31.23000
LogP 2.42
Appearance of Characters Colorless to yellow Solution
Vapour Pressure 0.1±0.4 mmHg at 25°C
Index of Refraction n20/D 1.4685(lit.)
Storage condition 2~8℃

 Safety Information

Hazard Codes Xi
Risk Phrases R36/37/38
Safety Phrases S26
WGK Germany 3
HS Code 2933990090

 Synthetic Route

Pyrrole structure

Pyrrole

CAS#:109-97-7
Di-tert-butyl dicarbonate structure

Di-tert-butyl d...

CAS#:24424-99-5

~94%

N-BOC-Pyrrole Structure

N-BOC-Pyrrole

CAS#:5176-27-2
Literature: Salman, Husein; Abraham, Yael; Tal, Shay; Meltzman, Shai; Kapon, Moshe; Tessler, Nir; Speiser, Shammai; Eichen, Yoav European Journal of Organic Chemistry, 2005 , # 11 p. 2207 - 2212
dimethyl 7-(tert-butyloxycarbonyl)-7-azabicyclo[2.2.1.]-hepta-2,5-diene-2,3-dicarboxylate structure

dimethyl 7-(ter...

CAS#:114221-05-5
N-Phenylbenzohydroxamic acid structure

N-Phenylbenzohy...

CAS#:934-16-7

~57%

3-Phenylisoxazole structure

3-Phenylisoxazole

CAS#:1006-65-1
N-BOC-Pyrrole Structure

N-BOC-Pyrrole

CAS#:5176-27-2

Detail
Literature: Keana, John F. W.; Heo, Gwi Suk; Mann, Jeffry S.; Nice, Faith L. Van; Lex, Laszlo; et al. Journal of Organic Chemistry, 1988 , vol. 53, # 10 p. 2268 - 2274
Pyrrole structure

Pyrrole

CAS#:109-97-7
TRIMETHYLACETIC ANHYDRIDE structure

TRIMETHYLACETIC...

CAS#:1538-75-6

~64%

N-BOC-Pyrrole Structure

N-BOC-Pyrrole

CAS#:5176-27-2
Literature: Fraile, Jose M.; Le Jeune, Karel; Mayoral, Jose A.; Ravasio, Nicoletta; Zaccheria, Federica Organic and Biomolecular Chemistry, 2013 , vol. 11, # 26 p. 4327 - 4332
N-Boc-3-pyrroline structure

N-Boc-3-pyrroline

CAS#:73286-70-1

~%

N-BOC-Pyrrole Structure

N-BOC-Pyrrole

CAS#:5176-27-2
Literature: Hodgson, David M.; Miles, Timothy J.; Witherington, Jason Tetrahedron, 2003 , vol. 59, # 49 p. 9729 - 9742
Pyrrole structure

Pyrrole

CAS#:109-97-7
Di-tert-butyl carbonate structure

Di-tert-butyl c...

CAS#:34619-03-9

~%

N-BOC-Pyrrole Structure

N-BOC-Pyrrole

CAS#:5176-27-2
Literature: Chen, Zhengming; Trudell, Mark L. Tetrahedron Letters, 1994 , vol. 35, # 52 p. 9649 - 9652
4-Iodoanisole structure

4-Iodoanisole

CAS#:696-62-8
tert-butyl 2-tributylstannylpyrrole-1-carboxylate structure

tert-butyl 2-tr...

CAS#:172282-33-6

~%

N-BOC-Pyrrole Structure

N-BOC-Pyrrole

CAS#:5176-27-2

2-(4-methoxyphenyl)-1H-pyrrole-1-carboxylic acid 1,1-dimethylethyl ester structure

2-(4-methoxyphe...

CAS#:198981-85-0
Literature: Basaric, Nikola; Baruah, Mukulesh; Qin, Wenwu; Metten, Bert; Smet, Mario; Dehaen, Wim; Boens, Noel Organic and Biomolecular Chemistry, 2005 , vol. 3, # 15 p. 2755 - 2761
tert-Butyl allylcarbamate structure

tert-Butyl ally...

CAS#:78888-18-3
Crotonaldehyde structure

Crotonaldehyde

CAS#:123-73-9

~61%

N-BOC-Pyrrole Structure

N-BOC-Pyrrole

CAS#:5176-27-2
Literature: Shafi, Syed; Kedziorek, Mariusz; Grela, Karol Synlett, 2011 , # 1 art. no. G30810ST, p. 124 - 128
Pyrrole structure

Pyrrole

CAS#:109-97-7
Carbonazidic acid,1,1-dimethylethyl ester structure

Carbonazidic ac...

CAS#:1070-19-5

~%

N-BOC-Pyrrole Structure

N-BOC-Pyrrole

CAS#:5176-27-2
Literature: Koh, Ming Joo; Khan, R. Kashif M.; Torker, Sebastian; Hoveyda, Amir H. Angewandte Chemie - International Edition, 2014 , vol. 53, # 7 p. 1968 - 1972 Angew. Chem., 2014 , vol. 126, # 7 p. 1999 - 2003,5
Pyrrole structure

Pyrrole

CAS#:109-97-7
tert-Butyl phenyl carbonate structure

tert-Butyl phen...

CAS#:6627-89-0

~79%

N-BOC-Pyrrole Structure

N-BOC-Pyrrole

CAS#:5176-27-2
Literature: Dhanak, Dashyant; Reese, Colin B. Journal of the Chemical Society, Perkin Transactions 1: Organic and Bio-Organic Chemistry (1972-1999), 1986 , p. 2181 - 2186

 Customs

HS Code 2933990090
Summary 2933990090. heterocyclic compounds with nitrogen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

 Synonyms

1H-Pyrrole-1-carboxylic acid, 1,1-dimethylethyl ester
tert-butyl pyrrole-1-carboxylate
2-Methyl-2-propanyl 1H-pyrrole-1-carboxylate
tert-butyl 1H-pyrrole-1-carboxylate
N-BOC-Pyrrole
t-Butyl 1H-pyrrole-1-carboxylate
MFCD00209559
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N-Boc-pyrrole
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1-N-BOC-PYRROLE-3-BORONIC ACID
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2-(2'-N-BOC-PYRROLE)BENZOICACID
669713-99-9
3-(2'-N-BOC-PYRROLE)BENZOICACID
669713-97-7
2-(2'-N-BOC-PYRROLE)BENZOIC ACID
78617-18-2
2-(2'-N-BOC-PYRROLE)BENZOIC ACID
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2-(2'-N-BOC-PYRROLE)BENZOIC ACID
5703-21-9
4-(2'-N-BOC-PYRROLE)PHENYLACETICACID
886363-15-1
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