tert-Butyl methyl(3-nitrophenyl)carbamate

Modify Date: 2025-09-11 12:07:53

tert-Butyl methyl(3-nitrophenyl)carbamate Structure
tert-Butyl methyl(3-nitrophenyl)carbamate structure
Common Name tert-Butyl methyl(3-nitrophenyl)carbamate
CAS Number 528882-15-7 Molecular Weight 252.26600
Density 1.208g/cm3 Boiling Point 348.63ºC at 760 mmHg
Molecular Formula C12H16N2O4 Melting Point N/A
MSDS N/A Flash Point 164.646ºC

 Names

Name tert-butyl N-methyl-N-(3-nitrophenyl)carbamate
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.208g/cm3
Boiling Point 348.63ºC at 760 mmHg
Molecular Formula C12H16N2O4
Molecular Weight 252.26600
Flash Point 164.646ºC
Exact Mass 252.11100
PSA 75.36000
LogP 3.48930
Index of Refraction 1.559
InChIKey VILMFFGDPISPFQ-UHFFFAOYSA-N
SMILES CN(C(=O)OC(C)(C)C)c1cccc([N+](=O)[O-])c1

 Safety Information

HS Code 2924299090

 Synthetic Route

~97%

tert-Butyl methyl(3-nitrophenyl)carbamate Structure

tert-Butyl meth...

CAS#:528882-15-7

Literature: Pharmacyclics, Inc.; CHEN, Wei; LOURY, David J. Patent: US2013/197014 A1, 2013 ; Location in patent: Paragraph 0715; 0717 ;

~89%

tert-Butyl methyl(3-nitrophenyl)carbamate Structure

tert-Butyl meth...

CAS#:528882-15-7

Literature: JOHNSON and JOHNSON Patent: WO2004/101533 A1, 2004 ; Location in patent: Page 26 ;

~94%

tert-Butyl methyl(3-nitrophenyl)carbamate Structure

tert-Butyl meth...

CAS#:528882-15-7

Literature: F. HOFFMANN-LA ROCHE AG; HOFFMANN-LA ROCHE INC.; CHEN, Zhi; ERICKSON, Shawn David Patent: WO2014/60328 A1, 2014 ; Location in patent: Page/Page column 16 ;

~%

tert-Butyl methyl(3-nitrophenyl)carbamate Structure

tert-Butyl meth...

CAS#:528882-15-7

Literature: McDonald, Iain M.; Austin, Carol; Buck, Ildiko M.; Dunstone, David J.; Griffin, Eric; Harper, Elaine A.; Hull, Robert A. D.; Kalindjian, S. Barret; Linney, Ian D.; Low, Caroline M. R.; Pether, Michael J.; Spencer, John; Wright, Paul T.; Adatia, Trushar; Bashall, Alan Journal of Medicinal Chemistry, 2006 , vol. 49, # 7 p. 2253 - 2261

~%

tert-Butyl methyl(3-nitrophenyl)carbamate Structure

tert-Butyl meth...

CAS#:528882-15-7

Literature: TAKEDA PHARMACEUTICAL COMPANY LIMITED Patent: US2011/237620 A1, 2011 ; US 20110237620 A1

~%

tert-Butyl methyl(3-nitrophenyl)carbamate Structure

tert-Butyl meth...

CAS#:528882-15-7

Literature: TAKEDA PHARMACEUTICAL COMPANY LIMITED Patent: US2011/237620 A1, 2011 ; US 20110237620 A1

 Customs

HS Code 2924299090
Summary 2924299090. other cyclic amides (including cyclic carbamates) and their derivatives; salts thereof. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0%

 Synonyms

tert-butyl methyl(3-nitrophenyl)carbamate
N-methyl-(3-nitrophenyl)carbamic acid tert-butyl ester
tert-butyl (3-nitrophenyl)methylcarbamate
methyl-(3-nitro-phenyl)-carbamic acid tert-butyl ester
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