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tert-butyl N-(1-aminobutan-2-yl)carbamate

HCID 14769741
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Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
732219-83-9
Standard SMILES
CCC(CN)NC(=O)OC(C)(C)C
InChIKey
KGJCYTMWAXWVOM-UHFFFAOYSA-N
Molecular formula
C9H20N2O2
Average molar mass
188.27 g/mol
Monoisotopic mass
188.15247789

Names & identifiers

Preferred name
tert-butyl N-(1-aminobutan-2-yl)carbamate
IUPAC
tert-butyl N-(1-aminobutan-2-yl)carbamate
English name
Carbamic acid, [1-(aminomethyl)propyl]-, 1,1-dimethylethyl ester (9CI)
Molecular formula
C9H20N2O2
Molecular weight
188.27

Names & synonyms

732219-83-9tert-butyl N-(1-aminobutan-2-yl)carbamateRefChem:895329823-409-3tert-Butyl (1-aminobutan-2-yl)carbamateN-Boc-[1-(aminomethyl)propyl]amineCarbamic acid, [1-(aminomethyl)propyl]-, 1,1-dimethylethyl ester (9CI)MFCD16660180SCHEMBL8580812-N-Boc-butane-1,2-diamineCHEMBL4558570BKA32589
Show more names
2-(Boc-amino)-1-butanamineCarbamic acid, N-[1-(aminomethyl)propyl]-, 1,1-dimethylethyl ester
GNB12505HEB21983AKOS012968937SB44960SB44962tert-Butyl(1-aminobutan-2-yl)carbamateDB-074674EN300-72847

Database identifiers

CAS
732219-83-9
PubChem CID
14769741
ChEMBL
CHEMBL4558570
EC Number
823-409-3

Properties

Computed structural properties

XLogP
0.9
Topological polar surface area
64.4 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
3
Rotatable bonds
5
Heavy atoms
13
Formal charge
0
Complexity
163

Physicochemical properties

storage temp.
Store at Room Tem.
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
335 · H335-H315-H319
Precautionary statements
264 · P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362
HS Code
2924190090 · 2924190090

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

GHS classification

GHS Classification · 4 items

Warning

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

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+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

hs_code
2924190090
Signal word
Warning
Symbol(GHS)
GHS07
Hazard statements
H335-H315-H319
Precautionary statements
P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362

Chemistry & industry

Suppliers6 total

毕佳索(上海毕得医药科技股份有限公司)400-6005915 · [email protected]
苏州爱玛特生物科技有限公司0512-56316828 4008675858 · [email protected]
苏州爱玛特生物科技有限公司0512-56316828 400-867-5858;400-867-5858 · [email protected]
江苏艾康生物医药研发有限公司025-58859352 15955137747 · [email protected]
佰美济华(河南)医药科技有限公司0371-88900765 18037465274 · [email protected]
河南梦泰医药科技有限公司17634413542 · [email protected]

Related reactions

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Compound notes

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