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1H-PYRROLE-1-PROPANOICACID

1H-PYRROLE-1-PROPANOICACID structure

CAS No:
89059-06-3
Formula:
C7H9NO2
Chemical Name:
1H-PYRROLE-1-PROPANOICACID
Synonyms:
3-(1-pyrrolyl)propanoic acid;3-pyrrol-1-ylpropanoic acid;3-Pyrrolyl-1-yl-propionic acid, N-(2-Carboxyethyl)pyrrole, N-Pyrrolylpropanoic acid;1H-PYRROLE-1-PROPANOIC ACID;Pyrrole-1-propionic Acid;3-(1H-pyrrol-1-yl)propanoic acid(SALTDATA: FREE);1H-Pyrrole-1-propionic acid;3-Pyrrolyl-1-yl-propionic acid

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1H-PYRROLE-1-PROPANOICACID Basic Attributes

Molecular Weight：

139.15

Exact Mass：

139.063328530 g/mol

NSC Number：

168870

DSSTox ID：

DTXSID10305038

Characteristics

PSA：

42.2 Å²

Density：

1.14±0.1 g/cm3

Melting Point：

59-64 °C

Boiling Point：

125-135 °C(Press: 3 Torr)

PKA：

3.94±0.10

Safety Information

wgk germany：

hazard class code：

safety instructions：

Marks：

GHS Classification：

|Warning|H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]|P264, P280, P305+P351+P338, and P337+P313|Aggregated GHS information provided by 39 companies from 2 notifications to the ECHA C&L Inventory.

Drug Information

MeSH Entry Terms：

N-(2-carboxyethyl)pyrrole

Computed Properties

Molecular Weight:139.15
XLogP3:0.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:3
Exact Mass:139.063328530
Monoisotopic Mass:139.063328530
Topological Polar Surface Area:42.2
Heavy Atom Count:10
Complexity:119
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1H-PYRROLE-1-PROPANOICACID

Basic Attributes
Characteristics
Safety Information
Drug Information
Computed Properties

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