Pentanoic acid,4-methyl-4-nitro-, methyl ester

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Names

[ CAS No. ]:
16507-02-1

[ Name ]:
Pentanoic acid,4-methyl-4-nitro-, methyl ester

[Synonym ]:
MFCD00047757
methyl 4-methyl-4-nitropentanoate

Chemical & Physical Properties

[ Density]:
1.114 g/mL at 25ºC(lit.)

[ Boiling Point ]:
79ºC1 mm Hg(lit.)

[ Molecular Formula ]:
C7H13NO4

[ Molecular Weight ]:
175.18200

[ Flash Point ]:
>230 °F

[ Exact Mass ]:
175.08400

[ PSA ]:
72.12000

[ LogP ]:
1.51810

[ Vapour Pressure ]:
0.0298mmHg at 25°C

[ Index of Refraction ]:
n20/D 1.441(lit.)

Safety Information

[ Symbol ]:

GHS07

[ Signal Word ]:
Warning

[ Hazard Statements ]:
H315-H319-H335

[ Precautionary Statements ]:
P261-P305 + P351 + P338

[ Personal Protective Equipment ]:
Eyeshields;full-face respirator (US);Gloves;multi-purpose combination respirator cartridge (US);type ABEK (EN14387) respirator filter

[ Hazard Codes ]:
Xi

[ Risk Phrases ]:
R36/37/38

[ Safety Phrases ]:
S26;S37/S39

[ RIDADR ]:
NONH for all modes of transport

[ WGK Germany ]:
3

[ HS Code ]:
2915900090

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • 2-Nitropropane
  • acrylic acid methyl ester
  • 2-nitroprop-1-ene
  • Methyl 3-bromopropanoate

DownStream

  • Pentanoic acid, 4-amino-4-methyl-
  • 5,5-Dimethyl-2-pyrrolidinone
  • 2,2-DiMethylpyrrolidine
  • 4-methyl-4-nitro-pentanoic acid
  • 2-(2,2-dimethylpyrrolidin-1-yl)ethanol
  • 4-Amino-4-methyl-pentan-1-ol
  • 1-hydroxy-5,5-dimethylpyrrolidin-2-one
  • 4-methyl-4-nitro-pentan-1-ol

Customs

[ HS Code ]: 2915900090

[ Summary ]:
2915900090 other saturated acyclic monocarboxylic acids and their anhydrides, halides, peroxides and peroxyacids; their halogenated, sulphonated, nitrated or nitrosated derivatives VAT:17.0% Tax rebate rate:9.0% Supervision conditions:AB(certificate of inspection for goods inward,certificate of inspection for goods outward) MFN tariff:5.5% General tariff:30.0%

Related Compounds

  • methyl 5,5,5-trifluoro-4-methyl-4-nitropentanoate
  • Methyl 4-methyl-4-nitroso-2-trimethylsiloxy-pentanoate
  • Pentanoic acid, 4-methyl-3-oxo-, phenylmethyl ester
  • Pentanoic acid, 4-Methyl-3-oxo-, 1-Methylethyl ester
  • ethyl 4-methyl-4-nitro-pentanoate
  • 4-methyl-4-nitro-pentanoic acid
  • N-[5-(hydroxymethyl)bicyclo[3.1.0]hexan-2-yl]propanamide
  • Methyl 3-(1-ethoxyethenyl)-5-fluorobenzoate
  • 1,4,9-Trioxa-11-azadispiro[4.2.5^{8}.2^{5}]pentadecan-10-one
  • 9-(Propan-2-yl)-1-oxa-3-azaspiro[5.5]undecan-2-one
  • (8R,10S)-8,10-dimethyl-1,9-dioxa-3-azaspiro[5.5]undecan-2-one
  • 1-(3-Amino-5-chloropyridin-2-yl)azetidine-2-carboxamide
  • tert-butyl N-benzyl-N-(2-oxopent-4-yn-1-yl)carbamate
  • 3-Amino-5-bromo-1-(5-fluoropentyl)-1,4-dihydropyridin-4-one
  • 5-(4-amino-1H-pyrazol-1-yl)pentanamide
  • 5-[(4-amino-3,5-dimethyl-1H-pyrazol-1-yl)methyl]pyrrolidin-2-one