tert-Butyl 4-amino-3-methoxypiperidine-1-carboxylate

HCID 53396191
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Basic information

CAS
1260639-98-2
Standard SMILES
COC1CN(C(=O)OC(C)(C)C)CCC1N
InChIKey
QNGHCFVWYKWWMU-UHFFFAOYSA-N
Molecular formula
C11H22N2O3
Average molar mass
230.3 g/mol

Overview

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Names & identifiers

Preferred name
tert-Butyl 4-amino-3-methoxypiperidine-1-carboxylate
IUPAC
tert-butyl 4-amino-3-methoxypiperidine-1-carboxylate
English name
1-Boc-3-methoxy-piperidin-4-ylamine
Molecular formula
C11H22N2O3
Molecular weight
230.3

Names & synonyms

1260639-98-2tert-Butyl 4-amino-3-methoxypiperidine-1-carboxylate1-Boc-3-methoxy-piperidin-4-ylamineMFCD15474948tert-Butyl 4-amino-3-methoxy-piperidine-1-carboxylateCis-4-Amino-1-Boc-3-methoxypiperidinePB15926PB16997AS-51052P11796tert-Butyl (3R,4R)-4-amino-3-methoxy-piperidine-1-carboxylateSY099937
Show more names
1-Boc-3-methoxy-piperidin-4-ylamine - [M13597]1-Piperidinecarboxylic acid, 4-amino-3-methoxy-, 1,1-dimethylethyl ester
(3S,4R)-1-Boc-3-methoxypiperidin-4-aminetert-Butyl (3S,4R)-4-amino-3-methoxy-piperidine-1-carboxylateSCHEMBL2845785QNGHCFVWYKWWMU-UHFFFAOYSA-N1-Boc-3-methoxypiperidin-4-amineAKOS022686905PB16829PB22234

Database identifiers

CAS
1260639-98-2
PubChem CID
53396191
EC Number
173-860-9

Properties

Computed structural properties

XLogP
0.3
Topological polar surface area
64.8 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
3
Heavy atoms
16

Physicochemical properties

Boiling point
306.2 · 306.2±42.0 °C(Predicted)
Density
1.07 · 1.07±0.1 g/cm3(Predicted)
pka
9.42 · 9.42±0.40(Predicted)
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
302 · H302-H315-H319-H335

Safety & regulation

GHS classification

GHS Classification · 4 items

Danger

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P332+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Hazard information

Hazard Classes and CategoriesSkin Irrit. 2 (100%)

Safety data

Signal word
Warning
Symbol(GHS)
GHS07
Hazard statements
H302-H315-H319-H335
Precautionary statements
P261-P264-P270-P271-P280-P301+P312-P302+P352-P304+P340-P305+P351+P338-P330-P332+P313-P337+P313-P362-P403+P233-P405-P501

Chemistry & industry

Upstream & downstream products

Suppliers18 total

上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [email protected]
Suzhou ARTK Medchem Co., Ltd.+86-18168183658 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
北京索莱宝科技有限公司010-50973130 17801761073 · [email protected]

Related reactions

12 records
New reaction record

Compound notes

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