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N-(2-Furoyl)glycine

N-(2-Furoyl)glycine structure

CAS No:
5657-19-2
Formula:
C7H7NO4
Chemical Name:
N-(2-Furoyl)glycine
Synonyms:
Glycine,N-(2-furanylcarbonyl)-;Glycine,N-2-furoyl-;N-(2-Furanylcarbonyl)glycine;Furfuroylglycine;Pyromucuric acid;2-Furancarboxamide,N-(carboxymethyl)-;2-Furoylglycine;Furoylglycine;N-(2-Furoyl)glycine;[[(Furan-2-yl)carbonyl]amino]acetic acid;[(Furan-2-carbonyl)amino]acetic acid;2-[(Furan-2-carbonyl)amino]acetic acid;2-[(Furan-2-yl)formamido]acetic acid;2-(2-Furoylamino)acetic acid;2-(Furan-2-ylformamido)acetic acid
Categories:
Biochemical Engineering > Amino Acids and Derivatives

Description

Solid

N-(2-furoyl)glycine is a glycine derivative that is the carboxamide obtained by the formal condensation of the amino group of glycine with 2-furoic acid. It has a role as a human metabolite. It is a N-acylglycine and a member of furans. It derives from a 2-furoic acid. It is a conjugate acid of a N-(2-furoyl)glycinate.

N-(2-Furoyl)glycine Basic Attributes

Molecular Weight：

169.13

Exact Mass：

169.13

DSSTox ID：

DTXSID50205124

HScode：

2932190090

Characteristics

PSA：

79.5

XLogP3：

0.48490

Appearance：

Solid

Density：

1.28g/cm3

Melting Point：

165 °C

Boiling Point：

440.6ºC at 760 mmHg

Flash Point：

220.3ºC

Refractive Index：

1.676

Water Solubility：

31.7 mg/mL

Collision Cross Section：

134.65 Å² [M-H]- [CCS Type: DT, Method: single field calibrated with Agilent tune mix (Agilent)]

Safety Information

Hazard category：

IRRITANT

Transport codes：

NONH for all modes of transport

wgk germany：

hazard class code：

36/37/38

safety instructions：

26-36

RTECS Number：

MC0555300

Marks：

Precautionary statement(s)：

P261-P305 + P351 + P338

Hazard Statements：

H315-H319-H335

GHS Classification：

|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 39 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Drug Information

MeSH Entry Terms：

furoylglycine

Computed Properties

Molecular Weight:169.13
XLogP3:-0.1
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:169.03750770
Monoisotopic Mass:169.03750770
Topological Polar Surface Area:79.5
Heavy Atom Count:12
Complexity:192
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of N-(2-Furoyl)glycine

Description
Basic Attributes
Characteristics
Safety Information
Drug Information
Computed Properties
Learn More Other Chemicals

N-(2-Furoyl)glycine

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