기본 정보
- 표준 SMILES
CC(C)(c1ccccc1)c1ccc(Nc2ccc(C(C)(C)c3ccccc3)cc2)cc1- InChIKey
UJAWGGOCYUPCPS-UHFFFAOYSA-N- 분자식
- C30H31N
- 평균 분자량
- 405.6 g/mol
- 단동위원소 질량
- 405.24564999
이름 및 식별자
- 우선 이름
- Benzenamine, 4-(1-methyl-1-phenylethyl)-N-[4-(1-methyl-1-phenylethyl)phenyl]-
- IUPAC
- 4-(2-phenylpropan-2-yl)-N-[4-(2-phenylpropan-2-yl)phenyl]aniline
- 현지명
- 4,4'-비스(알파, 알파-디메틸벤질)디페닐아민
- 영어명
- Bis[4-(2-phenyl-2-propyl)phenyl]amine
- 분자식
- C30H31N
- 분자량
- 405.57
이름 및 동의어
이름 더 보기
데이터베이스 식별자
- CAS
10081-67-1- PubChem CID
- 82343
- DTXSID
DTXSID0027721- ChEMBL
CHEMBL3184368- UNII
- 4Y29EDV7KQ
- EC Number
- 233-215-5
- Nikkaji
- J39.716D
물성
구조 계산 물성
- XLogP
- 9.1
- 극성 표면적
- 12 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 1
- 회전 가능 결합 수
- 6
- 무거운 원자 수
- 31
- 형식 전하
- 0
- 복잡도
- 473
실험 및 물리화학적 성질
물리화학적 성질
- 녹는점
- 100 °C · 100°C
- 끓는 점
- 535.2 · 535.2±39.0 °C(Predicted)
- 밀도
- 1.061 · 1.061±0.06 g/cm3(Predicted)
- 증기압
- 6.67 hPa · 6.67hPa at 20℃
- 저장 조건
- Sealed in dry,Room Temperature
- 용해도
- Practically insoluble in water
- 물리적 상태
- powder to crystal
- 산도 계수 (pKa)
- 1.59 · 1.59±0.50(Predicted)
- 색상
- 흰색에서 거의 흰색
- 수용성
- 6.7 μg/L · 6.7μg/L at 20℃
- InChI
- InChI=1S/C30H31N/c1-29(2,23-11-7-5-8-12-23)25-15-19-27(20-16-25)31-28-21-17-26(18-22-28)30(3,4)24-13-9-6-10-14-24/h5-22,31H,1-4H3
- InChIKey
- UJAWGGOCYUPCPS-UHFFFAOYSA-N
- SMILES
- C1(NC2=CC=C(C(C)(C3=CC=CC=C3)C)C=C2)=CC=C(C(C)(C2=CC=CC=C2)C)C=C1
- LogP
- 7.9 at · 7.9 at 25℃
- EPA
- 4 · Benzenamine, 4-(1-methyl-1-phenylethyl)-N-[4-(1-methyl-1-phenylethyl)phenyl]- (10081-67-1)
안전 및 규제
GHS 분류
GHS Classification
This chemical does not meet GHS hazard criteria for 76.9% (645 of 839) of all reports.
Warning
H317 (21.2%): May cause an allergic skin reaction [Warning Sensitization, Skin]
P261, P272, P273, P280, P302+P352, P321, P333+P317, P362+P364, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 839 reports by companies from 8 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
유해성 정보
Regulatory Information
Chemical: Benzenamine, 4-(1-methyl-1-phenylethyl)-N-[4-(1-methyl-1-phenylethyl)phenyl]-
Benzenamine, 4-(1-methyl-1-phenylethyl)-N-[4-(1-methyl-1-phenylethyl)phenyl]- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Benzenamine, 4-(1-methyl-1-phenylethyl)-N-[4-(1-methyl-1-phenylethyl)phenyl]- are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)
REACH registered substance: 4-(1-methyl-1-phenylethyl)-N-[4-(1-methyl-1-phenylethyl)phenyl]aniline (EC: 233-215-5)
Benzenamine, 4-(1-methyl-1-phenylethyl)-N-4-(1-methyl-1-phenylethyl)phenyl-: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.
안전 데이터
- tsca
- TSCA listed
- HS 번호
- 29214990
- risk_code
- 36/37/38-53
- safety_code
- 26-36/37/39
- 기존화학 물질
- KE-24815
화학 및 산업
용도 및 제조
General Manufacturing Information
All Other Basic Organic Chemical Manufacturing
Benzenamine, 4-(1-methyl-1-phenylethyl)-N-[4-(1-methyl-1-phenylethyl)phenyl]-: ACTIVE
응용 분야
개요4,4'-Diphenylisopropyl diphenylamine (Antioxidant HS-911) is a kind of high-efficient nontoxic Antioxidant to replace D, A, RD and so on which are carcinogenic. HS-911 can be used in NR, IIR, SBR, NBR, BR, CR and their blend, and is especially efficient in protecting CR from thermal aging. It can also be used in plastic industry. HS-911 not only can protect vulcanized rubber from thermal aging, light aging, ozone aging and damage caused by repeating deformation, but also has a passivating effect on heavy metal and transition metal.
용도Because of its light contamination, HS-911 can be used in insulative and protective rubber sheeting for color wires and cables as well as common color rubber products in place of Antioxidant 264, SP, 2264, MB, DNP, etc, to greatly reduce the production cost. In carbon black rubber, it has oxidation resistance of amine type, and will not pollute products. HS-911 can be exclusively used or used together with other Antioxidant . Normal dosage in rubber is 2-3 phr.
상·하류 제품 정보
상류 원료
공급사50 곳
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