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2-azepan-1-ylpropanoicacid(SALTDATA:HCl)

2-azepan-1-ylpropanoicacid(SALTDATA:HCl) structure

CAS No:
302914-01-8
Formula:
C9H17NO2
Chemical Name:
2-azepan-1-ylpropanoicacid(SALTDATA:HCl)
Synonyms:
2-azepan-1-ylpropanoic acid(SALTDATA: HCl);2-(1-AZEPANYL)PROPANOIC ACID;1H-Azepine-1-acetic acid, hexahydro-α-methyl-

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2-azepan-1-ylpropanoicacid(SALTDATA:HCl) Basic Attributes

Molecular Weight：

171.24

Exact Mass：

171.125928785

DSSTox ID：

DTXSID40700653

Characteristics

Density：

1.057±0.06 g/cm3

Boiling Point：

278.7±23.0 °C(Predicted)

PKA：

2.56±0.10

Safety Information

Hazard category：

IRRITANT

GHS Classification：

|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P264, P270, P280, P301+P312, P305+P351+P338, P330, P337+P313, and P501|Aggregated GHS information provided by 38 companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:171.24
XLogP3:-0.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:171.125928785
Monoisotopic Mass:171.125928785
Topological Polar Surface Area:40.5
Heavy Atom Count:12
Complexity:151
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Hot Searches: nateglinide; methyl alcohol structure; trestolone acetate; t-butyl chloride; nitrite formula; ethyl sulfate

Guide of 2-azepan-1-ylpropanoicacid(SALTDATA:HCl)

Basic Attributes
Characteristics
Safety Information
Computed Properties

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