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N-Pentylbenzenamine

N-Pentylbenzenamine structure

CAS No:
2655-27-8
Formula:
C11H17N
Chemical Name:
N-Pentylbenzenamine
Synonyms:
Benzenamine,N-pentyl-;Aniline,N-pentyl-;N-Pentylbenzenamine;N-Amylaniline;N-Pentylaniline;N-n-Amylaniline
Categories:
Pharmaceutical Intermediates > Heterocyclic Compound

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N-Pentylbenzenamine Basic Attributes

Molecular Weight：

163.26

Exact Mass：

163.26

EC Number：

220-183-2

DSSTox ID：

DTXSID20181123

HScode：

2921420090

Characteristics

PSA：

XLogP3：

3.3

Density：

0.933g/cm3

Melting Point：

46.25°C (estimate)

Boiling Point：

280-285 °C

Flash Point：

109.7ºC

Refractive Index：

1.534

Safety Information

wgk germany：

hazard class code：

20/21/22-36/37/38

safety instructions：

26-36/37/39

Precautionary statement(s)：

P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P501

Hazard Statements：

H302

GHS Classification：

|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Computed Properties

Molecular Weight:163.26
XLogP3:3.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:5
Exact Mass:163.136099547
Monoisotopic Mass:163.136099547
Topological Polar Surface Area:12
Heavy Atom Count:12
Complexity:95.2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes