1-N-tert-Butylbenzene-1,2-diamine

HCID 10583161
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Basic information

CAS
28458-68-6
Standard SMILES
CC(C)(C)Nc1ccccc1N
InChIKey
MOEDDZLJZIHCHG-UHFFFAOYSA-N
Molecular formula
C10H16N2
Average molar mass
164.25 g/mol
Monoisotopic mass
164.13134852

Names & identifiers

Preferred name
1-N-tert-Butylbenzene-1,2-diamine
IUPAC
2-N-tert-butylbenzene-1,2-diamine
English name
1-N-tert-Butylbenzene-1,2-diaMine
Molecular formula
C10H16N2
Molecular weight
164.25

Names & synonyms

28458-68-61-N-tert-Butylbenzene-1,2-diamineN1-(tert-Butyl)benzene-1,2-diamineN1-tert-butylbenzene-1,2-diamineMFCD106952401,2-Benzenediamine, N1-(1,1-dimethylethyl)-2-N-tert-butylbenzene-1,2-diamineN1-(tert-Butyl)-1,2-benzenediamineN-tert-butylbenzene-1,2-diamineSCHEMBL1269273N-t-butyl-benzene-1,2-diamineSCHEMBL29666932
Show more names
DTXSID00442007MOEDDZLJZIHCHG-UHFFFAOYSA-NN-tert-butyl-benzene-1,2-diamineN2-tert-butylbenzene-1,2-diamineDBA45868N~1~-tert-Butylbenzene-1,2-diamineAKOS005200573SB75780

Database identifiers

CAS
28458-68-6
PubChem CID
10583161
DTXSID
DTXSID00442007
Nikkaji
J3.607.362D

Properties

Computed structural properties

XLogP
2.2
Topological polar surface area
38.1 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
2
Rotatable bonds
2
Heavy atoms
12

Physicochemical properties

storage temp.
2 · under inert gas (nitrogen or Argon) at 2–8 °C
InChI
InChI=1S/C10H16N2/c1-10(2,3)12-9-7-5-4-6-8(9)11/h4-7,12H,11H2,1-3H3
InChIKey
MOEDDZLJZIHCHG-UHFFFAOYSA-N
SMILES
C1(NC(C)(C)C)=CC=CC=C1N
Symbol(GHS)
7 · GHS07
Signal word
Warning

Safety & regulation

Safety data

Signal word
Warning
Symbol(GHS)
GHS07
Hazard statements
H315-H319-H335
Precautionary statements
P261-P305+P351+P338

Chemistry & industry

Upstream & downstream products

Suppliers16 total

成都市久鼎化学技术有限公司18584079237 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [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]
安耐吉化学&3A（安徽泽升科技有限公司）021-58432009 400-005-6266 · [email protected]

Related reactions

3 records
New reaction record

Compound notes

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