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(S)-(+)-1-Benzyl-3-aminopyrrolidine

(S)-(+)-1-Benzyl-3-aminopyrrolidine structure

CAS No:
114715-38-7
Formula:
C11H16N2
Chemical Name:
(S)-(+)-1-Benzyl-3-aminopyrrolidine
Synonyms:
S-1-Benzyl-3-aminopyrrolidine; (3R)-1-Benzylpyrrolidin-3-amine; (3S)-(+)-1-Benzyl-3-aminopyrrolidine;
Categories:
Pharmaceutical Intermediates > Bulk Drug Intermediates

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(S)-(+)-1-Benzyl-3-aminopyrrolidine Basic Attributes

Molecular Weight：

176.25800

Exact Mass：

176.131348519 g/mol

HScode：

2933990090

Characteristics

PSA：

29.26000

XLogP3：

1.85780

Density：

1.02

Boiling Point：

100-105ºC 3mm

Flash Point：

>110ºC

Refractive Index：

1.545

Vapor Pressure：

0.0678mmHg at 25°C

Safety Information

Packing level：

III

Hazard category：

Transport codes：

UN 2735

wgk germany：

hazard class code：

R36/37/38

safety instructions：

S26-S36

Marks：

GHS Classification：

|Danger|H314 (14.89%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]|P260, P261, P264, P271, P280, P301+P330+P331, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P310, P312, P321, P332+P313, P337+P313, P362, P363, P403+P233, P405, and P501|Aggregated GHS information provided by 47 companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:176.26
XLogP3:1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:176.131348519
Monoisotopic Mass:176.131348519
Topological Polar Surface Area:29.3
Heavy Atom Count:13
Complexity:152
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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(S)-(+)-1-Benzyl-3-aminopyrrolidine

CAS No.: 114715-38-7

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Guide of (S)-(+)-1-Benzyl-3-aminopyrrolidine

Basic Attributes
Characteristics
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Computed Properties
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