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4-Heptanamine

4-Heptanamine structure

CAS No:
16751-59-0
Formula:
C7H17N
Chemical Name:
4-Heptanamine
Synonyms:
4-Heptanamine;Butylamine,1-propyl-;1-Propylbutylamine;4-Heptylamine;4-Aminoheptane;1-Propylbutanamine;(Heptan-4-yl)amine
Categories:
Pharmaceutical Intermediates > Bulk Drug Intermediates

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4-Heptanamine Basic Attributes

Molecular Weight：

115.22

Exact Mass：

115.22

EC Number：

240-814-5

DSSTox ID：

DTXSID5066116

HScode：

2921199090

Characteristics

PSA：

26.02000

XLogP3：

2.61420

Density：

0.771 g/cm³ @ Temp: 13 °C

Melting Point：

-19°C (estimate)

Boiling Point：

139.5 °C

Flash Point：

41.3ºC

Refractive Index：

1.4170 to 1.4190

Vapor Pressure：

6.41mmHg at 25°C

PKA：

11.04±0.35

Safety Information

Packing level：

III

Hazard category：

3/8

Transport codes：

2733

wgk germany：

hazard class code：

10-34-43-22

safety instructions：

16-26-37/39-53

RTECS Number：

EO6025000

Marks：

GHS Classification：

|Danger|H225 (25%): Highly Flammable liquid and vapor [Danger Flammable liquids]|P210, P233, P240, P241, P242, P243, P260, P264, P280, P301+P330+P331, P303+P361+P353, P304+P340, P305+P351+P338, P310, P321, P363, P370+P378, P403+P235, P405, and P501|Aggregated GHS information provided by 4 companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

4-Heptanamine Use and Manufacturing

Uses

4-Aminoheptane is used in organic syntheses.

Manufacturing Info：

4-Heptanamine: ACTIVE

Computed Properties

Molecular Weight:115.22
XLogP3:1.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:4
Exact Mass:115.136099547
Monoisotopic Mass:115.136099547
Topological Polar Surface Area:26
Heavy Atom Count:8
Complexity:37.7
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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